SODIUM 3-({[4-({4-[(4-ETHOXYPHENYL)AMINO]PHENYL}(4-{ETHYL[(3-SULFONATOPHENYL)METHYL]IMINIUMYL}CYCLOHEXA-2,5-DIEN-1-YLIDENE)METHYL)PHENYL](ETHYL)AMINO}METHYL)BENZENE-1-SULFONATE | CAS 6104-59-2

Catalog Id:
MM6104592

IUPAC:
BRILLIANTBLUER

CAS Number:
6104-59-2

Molecular Weight:
825.97

Formula:
C45H44N3NaO7S2

SMILES:
[Na+].CCOC1=CC=C(NC2=CC=C(C=C2)C(C2=CC=C(C=C2)N(CC)CC2=CC(=CC=C2)S([O-])(=O)=O)=C2C=CC(C=C2)=[N+](CC)CC2=CC=CC(=C2)S([O-])(=O)=O)C=C1

Preferred IUPAC Name:
SODIUM 3-({[4-({4-[(4-ETHOXYPHENYL)AMINO]PHENYL}(4-{ETHYL[(3-SULFONATOPHENYL)METHYL]IMINIUMYL}CYCLOHEXA-2,5-DIEN-1-YLIDENE)METHYL)PHENYL](ETHYL)AMINO}METHYL)BENZENE-1-SULFONATE

InChIKey:
InChIKey=NKLPQNGYXWVELD-UHFFFAOYSA-M

Categories:
Aliphatic Cyclic Structures, Aromatic Heterocycles, Amines, Aliphatic Amines, Tertiary Amines, Aromatic Cyclic Structures, Anilines, Secondary Amines, Benzyl Amines