1-[4-(3-chlorophenyl)piperidin-1-ium-4-yl]butan-1-one chloride

Systemtic Name: 1-[4-(3-chlorophenyl)piperidin-1-ium-4-yl]butan-1-one chloride Openeye Name: 1-[4-(3-chlorophenyl)piperidin-1-ium-4-yl]butan-1-one chloride CAS Name: 1-[4-(3-chlorophenyl)-4-piperidin-1-iumyl]-1-butanone chloride IUPAC Name: 1-[4-(3-chlorophenyl)piperidin-1-ium-4-yl]butan-1-one chloride Traditional Name: 1-[4-(3-chlorophenyl)piperidin-1-ium-4-yl]butan-1-one chloride Formula: C15H21Cl2NO MolecularWeight: 302.23934

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1(CC[NH2+]CC1)C2=CC(=CC=C2)Cl.[Cl-]

Isomeric SMILES

CCCC(=O)C1(CC[NH2+]CC1)C2=CC(=CC=C2)Cl.[Cl-]

InChI

InChI=1S/C15H20ClNO.ClH/c1-2-4-14(18)15(7-9-17-10-8-15)12-5-3-6-13(16)11-12;/h3,5-6,11,17H,2,4,7-10H2,1H3;1H