(2S)-3-(1H-imidazol-5-yl)-2-(phenoxycarbonylamino)propanoate

Systemtic Name: (2S)-3-(1H-imidazol-5-yl)-2-(phenoxycarbonylamino)propanoate Openeye Name: (2S)-3-(1H-imidazol-5-yl)-2-(phenoxycarbonylamino)propanoate CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[[oxo(phenoxy)methyl]amino]propanoate IUPAC Name: (2S)-3-(1H-imidazol-5-yl)-2-(phenoxycarbonylamino)propanoate Traditional Name: (2S)-2-(carbophenoxyamino)-3-(1H-imidazol-5-yl)propionate Formula: C13H12N3O4- MolecularWeight: 274.25208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)NC(CC2=CN=CN2)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)N[C@@H](CC2=CN=CN2)C(=O)[O-]

InChI

InChI=1S/C13H13N3O4/c17-12(18)11(6-9-7-14-8-15-9)16-13(19)20-10-4-2-1-3-5-10/h1-5,7-8,11H,6H2,(H,14,15)(H,16,19)(H,17,18)/p-1/t11-/m0/s1