2-[[3-(2-nitrophenyl)-3-oxidanylidene-propyl]-phenylmethoxycarbonyl-amino]ethyl ethanoate

Systemtic Name: 2-[[3-(2-nitrophenyl)-3-oxidanylidene-propyl]-phenylmethoxycarbonyl-amino]ethyl ethanoate Openeye Name: 2-[benzyloxycarbonyl-[3-(2-nitrophenyl)-3-oxo-propyl]amino]ethyl acetate CAS Name: acetic acid 2-[[3-(2-nitrophenyl)-3-oxopropyl]-phenylmethoxycarbonylamino]ethyl ester IUPAC Name: 2-[[3-(2-nitrophenyl)-3-oxopropyl]-phenylmethoxycarbonylamino]ethyl acetate Traditional Name: acetic acid 2-[carbobenzoxy-[3-keto-3-(2-nitrophenyl)propyl]amino]ethyl ester Formula: C21H22N2O7 MolecularWeight: 414.40858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN(CCC(=O)C1=CC=CC=C1[N+](=O)[O-])C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)OCCN(CCC(=O)C1=CC=CC=C1[N+](=O)[O-])C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H22N2O7/c1-16(24)29-14-13-22(21(26)30-15-17-7-3-2-4-8-17)12-11-20(25)18-9-5-6-10-19(18)23(27)28/h2-10H,11-15H2,1H3