8-[(4-nitrophenyl)carbonylamino]-3-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 8-[(4-nitrophenyl)carbonylamino]-3-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 3-hydroxy-8-[(4-nitrobenzoyl)amino]naphthalene-1-sulfonic acid CAS Name: 3-hydroxy-8-[[(4-nitrophenyl)-oxomethyl]amino]-1-naphthalenesulfonic acid IUPAC Name: 3-hydroxy-8-[(4-nitrobenzoyl)amino]naphthalene-1-sulfonic acid Traditional Name: 3-hydroxy-8-[(4-nitrobenzoyl)amino]naphthalene-1-sulfonic acid Formula: C17H12N2O7S MolecularWeight: 388.35138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=CC(=C2C(=C1)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)O)O

Isomeric SMILES

C1=CC2=CC(=CC(=C2C(=C1)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)O)O

InChI

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