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

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-ethyl] (3S)-1-(5-chloranyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(dimethylamino)-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-(dimethylamino)-2-oxoethyl] ester IUPAC Name: [2-(dimethylamino)-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-(dimethylamino)-2-keto-ethyl] ester Formula: C17H21ClN2O6 MolecularWeight: 384.81144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21ClN2O6/c1-19(2)16(22)9-26-17(23)10-5-15(21)20(8-10)12-6-11(18)13(24-3)7-14(12)25-4/h6-7,10H,5,8-9H2,1-4H3/t10-/m0/s1