(2S)-2-[(4-nitrophenyl)carbonylamino]-4-phenyl-pentanedioic acid

Systemtic Name: (2S)-2-[(4-nitrophenyl)carbonylamino]-4-phenyl-pentanedioic acid Openeye Name: (2S)-2-[(4-nitrobenzoyl)amino]-4-phenyl-pentanedioic acid CAS Name: (2S)-2-[[(4-nitrophenyl)-oxomethyl]amino]-4-phenylpentanedioic acid IUPAC Name: (2S)-2-[(4-nitrobenzoyl)amino]-4-phenylpentanedioic acid Traditional Name: (2S)-2-[(4-nitrobenzoyl)amino]-4-phenyl-glutaric acid Formula: C18H16N2O7 MolecularWeight: 372.32884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)C(C[C@@H](C(=O)O)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C18H16N2O7/c21-16(12-6-8-13(9-7-12)20(26)27)19-15(18(24)25)10-14(17(22)23)11-4-2-1-3-5-11/h1-9,14-15H,10H2,(H,19,21)(H,22,23)(H,24,25)/t14?,15-/m0/s1