methyl (2R)-3-(1H-imidazol-5-yl)-2-[3-(phenylmethoxycarbonylamino)propanoylamino]propanoate

Systemtic Name: methyl (2R)-3-(1H-imidazol-5-yl)-2-[3-(phenylmethoxycarbonylamino)propanoylamino]propanoate Openeye Name: methyl (2R)-2-[3-(benzyloxycarbonylamino)propanoylamino]-3-(1H-imidazol-5-yl)propanoate CAS Name: (2R)-3-(1H-imidazol-5-yl)-2-[[1-oxo-3-(phenylmethoxycarbonylamino)propyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-imidazol-5-yl)-2-[3-(phenylmethoxycarbonylamino)propanoylamino]propanoate Traditional Name: (2R)-2-[3-(benzyloxycarbonylamino)propanoylamino]-3-(1H-imidazol-5-yl)propionic acid methyl ester Formula: C18H22N4O5 MolecularWeight: 374.39108

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN=CN1)NC(=O)CCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H](CC1=CN=CN1)NC(=O)CCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22N4O5/c1-26-17(24)15(9-14-10-19-12-21-14)22-16(23)7-8-20-18(25)27-11-13-5-3-2-4-6-13/h2-6,10,12,15H,7-9,11H2,1H3,(H,19,21)(H,20,25)(H,22,23)/t15-/m1/s1