[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (3S)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] (3S)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] (3S)-1-(5-chloro-2,4-dimethoxy-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(5-chloro-2,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] (3S)-1-(5-chloro-2,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(5-chloro-2,4-dimethoxy-phenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C17H20ClN3O7 MolecularWeight: 413.8096

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)COC(=O)C1CC(=O)N(C1)C2=CC(=C(C=C2OC)OC)Cl

Isomeric SMILES

CNC(=O)NC(=O)COC(=O)[C@H]1CC(=O)N(C1)C2=CC(=C(C=C2OC)OC)Cl

InChI

InChI=1S/C17H20ClN3O7/c1-19-17(25)20-14(22)8-28-16(24)9-4-15(23)21(7-9)11-5-10(18)12(26-2)6-13(11)27-3/h5-6,9H,4,7-8H2,1-3H3,(H2,19,20,22,25)/t9-/m0/s1