methyl 1-[2-(3,4-dichlorophenyl)ethanoyl]-2-(pyrrolidin-1-ylmethyl)piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(3,4-dichlorophenyl)ethanoyl]-2-(pyrrolidin-1-ylmethyl)piperidine-4-carboxylate Openeye Name: methyl 1-[2-(3,4-dichlorophenyl)acetyl]-2-(pyrrolidin-1-ylmethyl)piperidine-4-carboxylate CAS Name: 1-[2-(3,4-dichlorophenyl)-1-oxoethyl]-2-(1-pyrrolidinylmethyl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3,4-dichlorophenyl)acetyl]-2-(pyrrolidin-1-ylmethyl)piperidine-4-carboxylate Traditional Name: 1-[2-(3,4-dichlorophenyl)acetyl]-2-(pyrrolidinomethyl)isonipecotic acid methyl ester Formula: C20H26Cl2N2O3 MolecularWeight: 413.33804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(C(C1)CN2CCCC2)C(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC(=O)C1CCN(C(C1)CN2CCCC2)C(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H26Cl2N2O3/c1-27-20(26)15-6-9-24(16(12-15)13-23-7-2-3-8-23)19(25)11-14-4-5-17(21)18(22)10-14/h4-5,10,15-16H,2-3,6-9,11-13H2,1H3