[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] (3S)-1-[(2-chlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] (3S)-1-[(2-chlorophenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] (3S)-1-[(2-chlorophenyl)methyl]-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[(2-chlorophenyl)methyl]-5-oxo-3-pyrrolidinecarboxylic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] (3S)-1-[(2-chlorophenyl)methyl]-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-chlorobenzyl)-5-keto-pyrrolidine-3-carboxylic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H22ClN3O5 MolecularWeight: 395.83738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C1CC(=O)N(C1)CC2=CC=CC=C2Cl

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)[C@H]1CC(=O)N(C1)CC2=CC=CC=C2Cl

InChI

InChI=1S/C18H22ClN3O5/c1-11(2)20-18(26)21-15(23)10-27-17(25)13-7-16(24)22(9-13)8-12-5-3-4-6-14(12)19/h3-6,11,13H,7-10H2,1-2H3,(H2,20,21,23,26)/t13-/m0/s1