ethyl 3-(3-nitrophenyl)-3-(2-phenylbutanoylamino)propanoate

Systemtic Name: ethyl 3-(3-nitrophenyl)-3-(2-phenylbutanoylamino)propanoate Openeye Name: ethyl 3-(3-nitrophenyl)-3-(2-phenylbutanoylamino)propanoate CAS Name: 3-(3-nitrophenyl)-3-[(1-oxo-2-phenylbutyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-(3-nitrophenyl)-3-(2-phenylbutanoylamino)propanoate Traditional Name: 3-(3-nitrophenyl)-3-(2-phenylbutanoylamino)propionic acid ethyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c1-3-18(15-9-6-5-7-10-15)21(25)22-19(14-20(24)28-4-2)16-11-8-12-17(13-16)23(26)27/h5-13,18-19H,3-4,14H2,1-2H3,(H,22,25)