1-(5-chloranyl-2-methoxy-phenyl)carbonyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)carbonyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(5-chloro-2-methoxy-benzoyl)-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[(5-chloro-2-methoxyphenyl)-oxomethyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-chloro-2-methoxybenzoyl)-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(5-chloro-2-methoxy-benzoyl)-N-(3-pyridylmethyl)isonipecotamide Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCC(CC2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C20H22ClN3O3/c1-27-18-5-4-16(21)11-17(18)20(26)24-9-6-15(7-10-24)19(25)23-13-14-3-2-8-22-12-14/h2-5,8,11-12,15H,6-7,9-10,13H2,1H3,(H,23,25)