5-[(3-nitrophenyl)carbonylamino]-7-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 5-[(3-nitrophenyl)carbonylamino]-7-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 7-hydroxy-5-[(3-nitrobenzoyl)amino]naphthalene-2-sulfonic acid CAS Name: 7-hydroxy-5-[[(3-nitrophenyl)-oxomethyl]amino]-2-naphthalenesulfonic acid IUPAC Name: 7-hydroxy-5-[(3-nitrobenzoyl)amino]naphthalene-2-sulfonic acid Traditional Name: 7-hydroxy-5-[(3-nitrobenzoyl)amino]naphthalene-2-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=C3C=CC(=CC3=CC(=C2)O)S(=O)(=O)O

Isomeric SMILES

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

InChI

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