(3E)-7-[(3-aminophenyl)carbonylamino]-3-(naphthalen-2-ylhydrazinylidene)-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: (3E)-7-[(3-aminophenyl)carbonylamino]-3-(naphthalen-2-ylhydrazinylidene)-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: (3E)-7-[(3-aminobenzoyl)amino]-3-(2-naphthylhydrazono)-4-oxo-naphthalene-2-sulfonic acid CAS Name: (3E)-7-[[(3-aminophenyl)-oxomethyl]amino]-3-(2-naphthalenylhydrazinylidene)-4-oxo-2-naphthalenesulfonic acid IUPAC Name: (3E)-7-[(3-aminobenzoyl)amino]-3-(naphthalen-2-ylhydrazinylidene)-4-oxonaphthalene-2-sulfonic acid Traditional Name: (3E)-7-[(3-aminobenzoyl)amino]-4-keto-3-(2-naphthylhydrazono)naphthalene-2-sulfonic acid Formula: C27H20N4O5S MolecularWeight: 512.5365

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NN=C3C(=CC4=C(C3=O)C=CC(=C4)NC(=O)C5=CC(=CC=C5)N)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)N/N=C\3/C(=CC4=C(C3=O)C=CC(=C4)NC(=O)C5=CC(=CC=C5)N)S(=O)(=O)O

InChI

InChI=1S/C27H20N4O5S/c28-20-7-3-6-18(12-20)27(33)29-21-10-11-23-19(14-21)15-24(37(34,35)36)25(26(23)32)31-30-22-9-8-16-4-1-2-5-17(16)13-22/h1-15,30H,28H2,(H,29,33)(H,34,35,36)/b31-25-