[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (3S)-1-(5-chloranyl-2-methoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (3S)-1-(5-chloranyl-2-methoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (3S)-1-(5-chloro-2-methoxy-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(5-chloro-2-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (3S)-1-(5-chloro-2-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(5-chloro-2-methoxy-phenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C18H22ClN3O6 MolecularWeight: 411.83678

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1CC(=O)N(C1)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)[C@H]1CC(=O)N(C1)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C18H22ClN3O6/c1-3-6-20-18(26)21-15(23)10-28-17(25)11-7-16(24)22(9-11)13-8-12(19)4-5-14(13)27-2/h4-5,8,11H,3,6-7,9-10H2,1-2H3,(H2,20,21,23,26)/t11-/m0/s1