6-[(3-nitrophenyl)carbonylamino]-4-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 6-[(3-nitrophenyl)carbonylamino]-4-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 4-hydroxy-6-[(3-nitrobenzoyl)amino]naphthalene-2-sulfonic acid CAS Name: 4-hydroxy-6-[[(3-nitrophenyl)-oxomethyl]amino]-2-naphthalenesulfonic acid IUPAC Name: 4-hydroxy-6-[(3-nitrobenzoyl)amino]naphthalene-2-sulfonic acid Traditional Name: 4-hydroxy-6-[(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=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)O

Isomeric SMILES

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

InChI

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