(phenylmethyl) (2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-4-oxidanylideneazetidin-2-yl]carbonylamino]propanoate

Systemtic Name: (phenylmethyl) (2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-4-oxidanylideneazetidin-2-yl]carbonylamino]propanoate Openeye Name: benzyl (2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-4-oxoazetidine-2-carbonyl]amino]propanoate CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[[oxo-[(2S)-4-oxo-2-azetidinyl]methyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-4-oxoazetidine-2-carbonyl]amino]propanoate Traditional Name: (2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-4-ketoazetidine-2-carbonyl]amino]propionic acid benzyl ester Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC1=O)C(=O)NC(CC2=CN=CN2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1[C@H](NC1=O)C(=O)N[C@@H](CC2=CN=CN2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H18N4O4/c22-15-7-13(20-15)16(23)21-14(6-12-8-18-10-19-12)17(24)25-9-11-4-2-1-3-5-11/h1-5,8,10,13-14H,6-7,9H2,(H,18,19)(H,20,22)(H,21,23)/t13-,14-/m0/s1