ethyl 4-[(4-chlorophenyl)methyl]-1-[1-(4-methylpyridin-2-yl)propan-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(4-chlorophenyl)methyl]-1-[1-(4-methylpyridin-2-yl)propan-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 4-[(4-chlorophenyl)methyl]-1-[1-methyl-2-(4-methyl-2-pyridyl)ethyl]piperidine-4-carboxylate CAS Name: 4-[(4-chlorophenyl)methyl]-1-[1-(4-methyl-2-pyridinyl)propan-2-yl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-chlorophenyl)methyl]-1-[1-(4-methylpyridin-2-yl)propan-2-yl]piperidine-4-carboxylate Traditional Name: 4-(4-chlorobenzyl)-1-[1-methyl-2-(4-methyl-2-pyridyl)ethyl]isonipecotic acid ethyl ester Formula: C24H31ClN2O2 MolecularWeight: 414.96814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(C)CC2=NC=CC(=C2)C)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(C)CC2=NC=CC(=C2)C)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H31ClN2O2/c1-4-29-23(28)24(17-20-5-7-21(25)8-6-20)10-13-27(14-11-24)19(3)16-22-15-18(2)9-12-26-22/h5-9,12,15,19H,4,10-11,13-14,16-17H2,1-3H3