(6E)-4-azanyl-6-[(4-methoxy-2-sulfo-phenyl)hydrazinylidene]-7-methyl-5-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (6E)-4-azanyl-6-[(4-methoxy-2-sulfo-phenyl)hydrazinylidene]-7-methyl-5-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (6E)-4-amino-6-[(4-methoxy-2-sulfo-phenyl)hydrazono]-7-methyl-5-oxo-naphthalene-2-sulfonic acid CAS Name: (6E)-4-amino-6-[(4-methoxy-2-sulfophenyl)hydrazinylidene]-7-methyl-5-oxo-2-naphthalenesulfonic acid IUPAC Name: (6E)-4-amino-6-[(4-methoxy-2-sulfophenyl)hydrazinylidene]-7-methyl-5-oxonaphthalene-2-sulfonic acid Traditional Name: (6E)-4-amino-5-keto-6-[(4-methoxy-2-sulfo-phenyl)hydrazono]-7-methyl-naphthalene-2-sulfonic acid Formula: C18H17N3O8S2 MolecularWeight: 467.47288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=CC(=C2C(=O)C1=NNC3=C(C=C(C=C3)OC)S(=O)(=O)O)N)S(=O)(=O)O

Isomeric SMILES

CC\1=CC2=CC(=CC(=C2C(=O)/C1=N/NC3=C(C=C(C=C3)OC)S(=O)(=O)O)N)S(=O)(=O)O

InChI

InChI=1S/C18H17N3O8S2/c1-9-5-10-6-12(30(23,24)25)8-13(19)16(10)18(22)17(9)21-20-14-4-3-11(29-2)7-15(14)31(26,27)28/h3-8,20H,19H2,1-2H3,(H,23,24,25)(H,26,27,28)/b21-17+