1-[[2-(4-chloranyl-3,5-dimethoxy-phenyl)pyridin-4-yl]methyl]piperidin-4-one; ethene

Systemtic Name: 1-[[2-(4-chloranyl-3,5-dimethoxy-phenyl)pyridin-4-yl]methyl]piperidin-4-one; ethene Openeye Name: 1-[[2-(4-chloro-3,5-dimethoxy-phenyl)-4-pyridyl]methyl]piperidin-4-one; ethylene CAS Name: 1-[[2-(4-chloro-3,5-dimethoxyphenyl)-4-pyridinyl]methyl]-4-piperidinone; ethene IUPAC Name: 1-[[2-(4-chloro-3,5-dimethoxyphenyl)pyridin-4-yl]methyl]piperidin-4-one; ethene Traditional Name: 1-[[2-(4-chloro-3,5-dimethoxy-phenyl)-4-pyridyl]methyl]-4-piperidone; ethylene Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Cl)OC)C2=NC=CC(=C2)CN3CCC(=O)CC3.C=C

Isomeric SMILES

COC1=CC(=CC(=C1Cl)OC)C2=NC=CC(=C2)CN3CCC(=O)CC3.C=C

InChI

InChI=1S/C19H21ClN2O3.C2H4/c1-24-17-10-14(11-18(25-2)19(17)20)16-9-13(3-6-21-16)12-22-7-4-15(23)5-8-22;1-2/h3,6,9-11H,4-5,7-8,12H2,1-2H3;1-2H2