5-(3,4-dichlorophenyl)-1-ethanoyl-1-pyridin-2-yl-piperidin-1-ium-2-one hydrochloride

Systemtic Name: 5-(3,4-dichlorophenyl)-1-ethanoyl-1-pyridin-2-yl-piperidin-1-ium-2-one hydrochloride Openeye Name: 1-acetyl-5-(3,4-dichlorophenyl)-1-(2-pyridyl)piperidin-1-ium-2-one hydrochloride CAS Name: 1-acetyl-5-(3,4-dichlorophenyl)-1-(2-pyridinyl)-2-piperidin-1-iumone hydrochloride IUPAC Name: 1-acetyl-5-(3,4-dichlorophenyl)-1-pyridin-2-ylpiperidin-1-ium-2-one hydrochloride Traditional Name: 1-acetyl-5-(3,4-dichlorophenyl)-1-(2-pyridyl)piperidin-1-ium-2-one hydrochloride Formula: C18H18Cl3N2O2+ MolecularWeight: 400.70672

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[N+]1(CC(CCC1=O)C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=N3.Cl

Isomeric SMILES

CC(=O)[N+]1(CC(CCC1=O)C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=N3.Cl

InChI

InChI=1S/C18H17Cl2N2O2.ClH/c1-12(23)22(17-4-2-3-9-21-17)11-14(6-8-18(22)24)13-5-7-15(19)16(20)10-13;/h2-5,7,9-10,14H,6,8,11H2,1H3;1H/q+1;