(phenylmethyl) (2S)-2-[[(3R)-1-(2-azanyl-2-oxidanylidene-ethyl)-2-oxidanylidene-azetidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[[(3R)-1-(2-azanyl-2-oxidanylidene-ethyl)-2-oxidanylidene-azetidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[[(3R)-1-(2-amino-2-oxo-ethyl)-2-oxo-azetidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[[[(3R)-1-(2-amino-2-oxoethyl)-2-oxo-3-azetidinyl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(3R)-1-(2-amino-2-oxoethyl)-2-oxoazetidin-3-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[(3R)-1-(2-amino-2-keto-ethyl)-2-keto-azetidin-3-yl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C18H22N4O5 MolecularWeight: 374.39108

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3CN(C3=O)CC(=O)N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)OCC2=CC=CC=C2)C(=O)N[C@@H]3CN(C3=O)CC(=O)N

InChI

InChI=1S/C18H22N4O5/c19-15(23)10-21-9-13(17(21)25)20-16(24)14-7-4-8-22(14)18(26)27-11-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2,(H2,19,23)(H,20,24)/t13-,14+/m1/s1