methyl 2-[[3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[[3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl 2-[[2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[3-hydroxy-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[3-hydroxy-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CO)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CO)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O6/c1-28-20(26)17(12-15-8-4-2-5-9-15)22-19(25)18(13-24)23-21(27)29-14-16-10-6-3-7-11-16/h2-11,17-18,24H,12-14H2,1H3,(H,22,25)(H,23,27)