(2R)-3-(1H-imidazol-5-yl)-2-[3-(phenylmethoxycarbonylamino)propanoylamino]propanoic acid

Systemtic Name: (2R)-3-(1H-imidazol-5-yl)-2-[3-(phenylmethoxycarbonylamino)propanoylamino]propanoic acid Openeye Name: (2R)-2-[3-(benzyloxycarbonylamino)propanoylamino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: (2R)-3-(1H-imidazol-5-yl)-2-[[1-oxo-3-(phenylmethoxycarbonylamino)propyl]amino]propanoic acid IUPAC Name: (2R)-3-(1H-imidazol-5-yl)-2-[3-(phenylmethoxycarbonylamino)propanoylamino]propanoic acid Traditional Name: (2R)-2-[3-(benzyloxycarbonylamino)propanoylamino]-3-(1H-imidazol-5-yl)propionic acid Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCC(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCC(=O)N[C@H](CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C17H20N4O5/c22-15(21-14(16(23)24)8-13-9-18-11-20-13)6-7-19-17(25)26-10-12-4-2-1-3-5-12/h1-5,9,11,14H,6-8,10H2,(H,18,20)(H,19,25)(H,21,22)(H,23,24)/t14-/m1/s1