Registration Dossier

General information

Inventory

EC number:
219-233-6
EC name:
3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]xanthylium chloride
CAS number:
2390-63-8

No inventory information available

Reference substance information

IUPAC name:
3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-10λ⁴-xanthen-10-ylium chloride
Synonyms
Names:
Xanthylium, 3,6-bis(diethylamino)-9-[ 2-(ethoxycarbonyl)phenyl]-, chloride
Xanthylium, 3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-, chloride
Identifier:
IUPAC name
3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]-10λ⁴-xanthen-10-ylium chloride
3,6-bis(diethylamino)-9-[2-(ethoxycarbonyl)phenyl]xanthenium chloride

CAS information

CAS number:
2390-63-8

Molecular and structural information

Molecular formula:
C30H35N2O3.Cl
Molecular weight:
507.063
SMILES notation:
[Cl-].CCOC(=O)c1ccccc1c2c3ccc(cc3[o+]c4cc(ccc24)N(CC)CC)N(CC)CC
InChl:
InChI=1/C30H35N2O3.ClH/c1-6-31(7-2)21-15-17-25-27(19-21)35-28-20-22(32(8-3)9-4)16-18-26(28)29(25)23-13-11-12-14-24(23)30(33)34-10-5;/h11-20H,6-10H2,1-5H3;1H/q+1;/p-1
Structural formula:
Chemical structure