4-[(4-nitrophenyl)carbonylamino]-6-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 4-[(4-nitrophenyl)carbonylamino]-6-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 6-hydroxy-4-[(4-nitrobenzoyl)amino]naphthalene-1-sulfonic acid CAS Name: 6-hydroxy-4-[[(4-nitrophenyl)-oxomethyl]amino]-1-naphthalenesulfonic acid IUPAC Name: 6-hydroxy-4-[(4-nitrobenzoyl)amino]naphthalene-1-sulfonic acid Traditional Name: 6-hydroxy-4-[(4-nitrobenzoyl)amino]naphthalene-1-sulfonic acid Formula: C17H12N2O7S MolecularWeight: 388.35138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C3C=C(C=CC3=C(C=C2)S(=O)(=O)O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C3C=C(C=CC3=C(C=C2)S(=O)(=O)O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O7S/c20-12-5-6-13-14(9-12)15(7-8-16(13)27(24,25)26)18-17(21)10-1-3-11(4-2-10)19(22)23/h1-9,20H,(H,18,21)(H,24,25,26)