7-[(2-acetamido-4-methyl-phenyl)diazenyl]-3-methyl-naphthalene-1-sulfonic acid

Systemtic Name: 7-[(2-acetamido-4-methyl-phenyl)diazenyl]-3-methyl-naphthalene-1-sulfonic acid Openeye Name: 7-(2-acetamido-4-methyl-phenyl)azo-3-methyl-naphthalene-1-sulfonic acid CAS Name: 7-(2-acetamido-4-methylphenyl)azo-3-methyl-1-naphthalenesulfonic acid IUPAC Name: 7-[(2-acetamido-4-methylphenyl)diazenyl]-3-methylnaphthalene-1-sulfonic acid Traditional Name: 7-(2-acetamido-4-methyl-phenyl)azo-3-methyl-naphthalene-1-sulfonic acid Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O4S/c1-12-4-7-18(19(9-12)21-14(3)24)23-22-16-6-5-15-8-13(2)10-20(17(15)11-16)28(25,26)27/h4-11H,1-3H3,(H,21,24)(H,25,26,27)