1-azanyl-4-[(4-methyl-2-sulfo-phenyl)diazenyl]naphthalene-2-sulfonic acid

Systemtic Name: 1-azanyl-4-[(4-methyl-2-sulfo-phenyl)diazenyl]naphthalene-2-sulfonic acid Openeye Name: 1-amino-4-(4-methyl-2-sulfo-phenyl)azo-naphthalene-2-sulfonic acid CAS Name: 1-amino-4-(4-methyl-2-sulfophenyl)azo-2-naphthalenesulfonic acid IUPAC Name: 1-amino-4-[(4-methyl-2-sulfophenyl)diazenyl]naphthalene-2-sulfonic acid Traditional Name: 1-amino-4-(4-methyl-2-sulfo-phenyl)azo-naphthalene-2-sulfonic acid Formula: C17H15N3O6S2 MolecularWeight: 421.4475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N=NC2=CC(=C(C3=CC=CC=C32)N)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N=NC2=CC(=C(C3=CC=CC=C32)N)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C17H15N3O6S2/c1-10-6-7-13(15(8-10)27(21,22)23)19-20-14-9-16(28(24,25)26)17(18)12-5-3-2-4-11(12)14/h2-9H,18H2,1H3,(H,21,22,23)(H,24,25,26)