ethyl 4-[[4-(5-chloranyl-2-methoxy-phenyl)piperidin-1-yl]methyl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-(5-chloranyl-2-methoxy-phenyl)piperidin-1-yl]methyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-(5-chloro-2-methoxy-phenyl)-1-piperidyl]methyl]piperidine-1-carboxylate CAS Name: 4-[[4-(5-chloro-2-methoxyphenyl)-1-piperidinyl]methyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(5-chloro-2-methoxyphenyl)piperidin-1-yl]methyl]piperidine-1-carboxylate Traditional Name: 4-[[4-(5-chloro-2-methoxy-phenyl)piperidino]methyl]piperidine-1-carboxylic acid ethyl ester Formula: C21H31ClN2O3 MolecularWeight: 394.93544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)CN2CCC(CC2)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)CN2CCC(CC2)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C21H31ClN2O3/c1-3-27-21(25)24-12-6-16(7-13-24)15-23-10-8-17(9-11-23)19-14-18(22)4-5-20(19)26-2/h4-5,14,16-17H,3,6-13,15H2,1-2H3