[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: 3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-phenyl-propionic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC(=O)C2=CC=CN2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC(=O)C2=CC=CN2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H22N2O5/c26-21(19-12-7-13-24-19)16-29-22(27)20(14-17-8-3-1-4-9-17)25-23(28)30-15-18-10-5-2-6-11-18/h1-13,20,24H,14-16H2,(H,25,28)