Registration Dossier

General information

Inventory

EC number:
263-606-6
EC name:
1-amino-4-(ethylamino)-9,10-dihydro-9,10-dioxoanthracene-2-carbonitrile
CAS number:
62570-50-7

No inventory information available

Reference substance information

IUPAC name:
1-amino-4-(ethylamino)-9,10-dioxo-9,10-dihydroanthracene-2-carbonitrile
Synonyms
Names:
2-Anthracenecarbonitrile, 1-amino-4-(ethylamino)-9,10-dihydro-9,10-dioxo-
Identifier:
CAS number
62570-50-7
Identifier:
IUPAC name
1-amino-4-(ethylamino)-9,10-dihydro-9,10-dioxoanthracene-2-carbonitrile
Identifier:
IUPAC name
1-amino-4-(ethylamino)-9,10-dioxo-9,10-dihydroanthracene-2-carbonitrile
Identifier:
other: InChl
1S/C17H13N3O2/c1-2-20-12-7-9(8-18)15(19)14-13(12)16(21)10-5-3-4-6-11(10)17(14)22/h3-7,20H,2,19H2,1H3
Identifier:
other: Molecular formula
C17H13N3O2
Identifier:
other: SMILES notation
CCNC1=C2C(=C(C(=C1)C#N)N)C(=O)C3=CC=CC=C3C2=O
Identifier:
other: SMILES notation
CCNC1=CC(C#N)=C(N)C2=C1C(=O)C1=C(C=CC=C1)C2=O
Identifier:
other: InChl
InChI=1S/C17H13N3O2/c1-2-20-12-7-9(8-18)15(19)14-13(12)16(21)10-5-3-4-6-11(10)17(14)22/h3-7,20H,2,19H2,1H3
Identifier:
other: SMILES notation
O=C(c(c(C(=O)c1c(NCC)cc(C#N)c2N)ccc3)c3)c12
1-Amino-4-(ethylamino)-9,10-dihydro-9,10-dioxoanthracene-2-carbonitrile

CAS information

CAS number:
62570-50-7

Molecular and structural information

Molecular formula:
C16H14N2O2
Molecular weight:
ca. 266.29
SMILES notation:
CCNc1cc(C#N)c(N)c2C(=O)c3ccccc3C(=O)c12
InChl:
InChI=1/C17H13N3O2/c1-2-20-12-7-9(8-18)15(19)14-13(12)16(21)10-5-3-4-6-11(10)17(14)22/h3-7,20H,2,19H2,1H3
Structural formula:
Chemical structure