2-[[4-[(4-azanyl-2-methyl-phenyl)diazenyl]-7-sulfo-naphthalen-1-yl]diazenyl]benzene-1,4-disulfonic acid

Systemtic Name: 2-[[4-[(4-azanyl-2-methyl-phenyl)diazenyl]-7-sulfo-naphthalen-1-yl]diazenyl]benzene-1,4-disulfonic acid Openeye Name: 2-[[4-(4-amino-2-methyl-phenyl)azo-7-sulfo-1-naphthyl]azo]benzene-1,4-disulfonic acid CAS Name: 2-[[4-(4-amino-2-methylphenyl)azo-7-sulfo-1-naphthalenyl]azo]benzene-1,4-disulfonic acid IUPAC Name: 2-[[4-[(4-amino-2-methylphenyl)diazenyl]-7-sulfonaphthalen-1-yl]diazenyl]benzene-1,4-disulfonic acid Traditional Name: 2-[[4-(4-amino-2-methyl-phenyl)azo-7-sulfo-1-naphthyl]azo]benzene-1,4-disulfonic acid Formula: C23H19N5O9S3 MolecularWeight: 605.62006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C(C=CC(=C4)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)N)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C(C=CC(=C4)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C23H19N5O9S3/c1-13-10-14(24)2-6-19(13)25-26-20-7-8-21(18-11-15(38(29,30)31)3-5-17(18)20)27-28-22-12-16(39(32,33)34)4-9-23(22)40(35,36)37/h2-12H,24H2,1H3,(H,29,30,31)(H,32,33,34)(H,35,36,37)