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

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] (3S)-1-(5-chloranyl-2-methoxy-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(isobutylamino)-2-oxo-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-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] (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-(isobutylamino)-2-keto-ethyl] ester Formula: C18H23ClN2O5 MolecularWeight: 382.83862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23ClN2O5/c1-11(2)8-20-16(22)10-26-18(24)12-6-17(23)21(9-12)14-7-13(19)4-5-15(14)25-3/h4-5,7,11-12H,6,8-10H2,1-3H3,(H,20,22)/t12-/m0/s1