3-[(3-nitrophenyl)carbonylamino]-7-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 3-[(3-nitrophenyl)carbonylamino]-7-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 7-hydroxy-3-[(3-nitrobenzoyl)amino]naphthalene-1-sulfonic acid CAS Name: 7-hydroxy-3-[[(3-nitrophenyl)-oxomethyl]amino]-1-naphthalenesulfonic acid IUPAC Name: 7-hydroxy-3-[(3-nitrobenzoyl)amino]naphthalene-1-sulfonic acid Traditional Name: 7-hydroxy-3-[(3-nitrobenzoyl)amino]naphthalene-1-sulfonic acid Formula: C17H12N2O7S MolecularWeight: 388.35138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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