methyl 4-acetamido-3-[2-(phenylmethoxycarbonylamino)ethanoyl]benzoate

Systemtic Name: methyl 4-acetamido-3-[2-(phenylmethoxycarbonylamino)ethanoyl]benzoate Openeye Name: methyl 4-acetamido-3-[2-(benzyloxycarbonylamino)acetyl]benzoate CAS Name: 4-acetamido-3-[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-acetamido-3-[2-(phenylmethoxycarbonylamino)acetyl]benzoate Traditional Name: 4-acetamido-3-[2-(benzyloxycarbonylamino)acetyl]benzoic acid methyl ester Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)C(=O)OC)C(=O)CNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)C(=O)OC)C(=O)CNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H20N2O6/c1-13(23)22-17-9-8-15(19(25)27-2)10-16(17)18(24)11-21-20(26)28-12-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3,(H,21,26)(H,22,23)