methyl 4-[[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]methyl]benzoate

Systemtic Name: methyl 4-[[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]methyl]benzoate Openeye Name: methyl 4-[[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]methyl]benzoate CAS Name: 4-[[[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]methyl]benzoate Traditional Name: 4-[[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]methyl]benzoic acid methyl ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O5/c1-14(22-20(25)27-13-16-6-4-3-5-7-16)18(23)21-12-15-8-10-17(11-9-15)19(24)26-2/h3-11,14H,12-13H2,1-2H3,(H,21,23)(H,22,25)/t14-/m0/s1