7-[(4-nitrophenyl)carbonylamino]-4-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 7-[(4-nitrophenyl)carbonylamino]-4-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 4-hydroxy-7-[(4-nitrobenzoyl)amino]naphthalene-1-sulfonic acid CAS Name: 4-hydroxy-7-[[(4-nitrophenyl)-oxomethyl]amino]-1-naphthalenesulfonic acid IUPAC Name: 4-hydroxy-7-[(4-nitrobenzoyl)amino]naphthalene-1-sulfonic acid Traditional Name: 4-hydroxy-7-[(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=CC3=C(C=CC(=C3C=C2)O)S(=O)(=O)O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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