6-(dimethylamino)-7-methyl-4-oxidanyl-5-[(2-sulfophenyl)diazenyl]naphthalene-2-sulfonic acid

Systemtic Name: 6-(dimethylamino)-7-methyl-4-oxidanyl-5-[(2-sulfophenyl)diazenyl]naphthalene-2-sulfonic acid Openeye Name: 6-(dimethylamino)-4-hydroxy-7-methyl-5-(2-sulfophenyl)azo-naphthalene-2-sulfonic acid CAS Name: 6-(dimethylamino)-4-hydroxy-7-methyl-5-(2-sulfophenyl)azo-2-naphthalenesulfonic acid IUPAC Name: 6-(dimethylamino)-4-hydroxy-7-methyl-5-[(2-sulfophenyl)diazenyl]naphthalene-2-sulfonic acid Traditional Name: 6-(dimethylamino)-4-hydroxy-7-methyl-5-(2-sulfophenyl)azo-naphthalene-2-sulfonic acid Formula: C19H19N3O7S2 MolecularWeight: 465.50006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1)C=C(C=C2O)S(=O)(=O)O)N=NC3=CC=CC=C3S(=O)(=O)O)N(C)C

Isomeric SMILES

CC1=C(C(=C2C(=C1)C=C(C=C2O)S(=O)(=O)O)N=NC3=CC=CC=C3S(=O)(=O)O)N(C)C

InChI

InChI=1S/C19H19N3O7S2/c1-11-8-12-9-13(30(24,25)26)10-15(23)17(12)18(19(11)22(2)3)21-20-14-6-4-5-7-16(14)31(27,28)29/h4-10,23H,1-3H3,(H,24,25,26)(H,27,28,29)