4-[(3-nitrophenyl)carbonylamino]-3-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 4-[(3-nitrophenyl)carbonylamino]-3-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 3-hydroxy-4-[(3-nitrobenzoyl)amino]naphthalene-1-sulfonic acid CAS Name: 3-hydroxy-4-[[(3-nitrophenyl)-oxomethyl]amino]-1-naphthalenesulfonic acid IUPAC Name: 3-hydroxy-4-[(3-nitrobenzoyl)amino]naphthalene-1-sulfonic acid Traditional Name: 3-hydroxy-4-[(3-nitrobenzoyl)amino]naphthalene-1-sulfonic acid Formula: C17H12N2O7S MolecularWeight: 388.35138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=C2NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=C2NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])O)S(=O)(=O)O

InChI

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