[2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-[(2-nitrophenyl)amino]butanoate

Systemtic Name: [2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-[(2-nitrophenyl)amino]butanoate Openeye Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-(2-nitroanilino)butanoate CAS Name: 4-(2-nitroanilino)butanoic acid [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-(2-nitroanilino)butanoate Traditional Name: 4-(2-nitroanilino)butyric acid [2-keto-2-[[(1R)-1-phenylethyl]amino]ethyl] ester Formula: C20H23N3O5 MolecularWeight: 385.41372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)COC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)COC(=O)CCCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5/c1-15(16-8-3-2-4-9-16)22-19(24)14-28-20(25)12-7-13-21-17-10-5-6-11-18(17)23(26)27/h2-6,8-11,15,21H,7,12-14H2,1H3,(H,22,24)/t15-/m1/s1