(2S)-2-[1-(2-nitrophenyl)ethoxycarbonylamino]pentanedioic acid

Systemtic Name: (2S)-2-[1-(2-nitrophenyl)ethoxycarbonylamino]pentanedioic acid Openeye Name: (2S)-2-[1-(2-nitrophenyl)ethoxycarbonylamino]pentanedioic acid CAS Name: (2S)-2-[[1-(2-nitrophenyl)ethoxy-oxomethyl]amino]pentanedioic acid IUPAC Name: (2S)-2-[1-(2-nitrophenyl)ethoxycarbonylamino]pentanedioic acid Traditional Name: (2S)-2-[1-(2-nitrophenyl)ethoxycarbonylamino]glutaric acid Formula: C14H16N2O8 MolecularWeight: 340.28544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C1=CC=CC=C1[N+](=O)[O-])OC(=O)N[C@@H](CCC(=O)O)C(=O)O

InChI

InChI=1S/C14H16N2O8/c1-8(9-4-2-3-5-11(9)16(22)23)24-14(21)15-10(13(19)20)6-7-12(17)18/h2-5,8,10H,6-7H2,1H3,(H,15,21)(H,17,18)(H,19,20)/t8?,10-/m0/s1