1-[(3-nitrophenyl)carbonylamino]-8-oxidanyl-naphthalene-2-sulfonic acid

Systemtic Name: 1-[(3-nitrophenyl)carbonylamino]-8-oxidanyl-naphthalene-2-sulfonic acid Openeye Name: 8-hydroxy-1-[(3-nitrobenzoyl)amino]naphthalene-2-sulfonic acid CAS Name: 8-hydroxy-1-[[(3-nitrophenyl)-oxomethyl]amino]-2-naphthalenesulfonic acid IUPAC Name: 8-hydroxy-1-[(3-nitrobenzoyl)amino]naphthalene-2-sulfonic acid Traditional Name: 8-hydroxy-1-[(3-nitrobenzoyl)amino]naphthalene-2-sulfonic acid Formula: C17H12N2O7S MolecularWeight: 388.35138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)O)C(=C(C=C2)S(=O)(=O)O)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C(=C1)O)C(=C(C=C2)S(=O)(=O)O)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

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