(1,5-dimethyl-4,6-diphenyl-piperidin-1-ium-3-yl)-phenyl-methanone chloride

Systemtic Name: (1,5-dimethyl-4,6-diphenyl-piperidin-1-ium-3-yl)-phenyl-methanone chloride Openeye Name: (1,5-dimethyl-4,6-diphenyl-piperidin-1-ium-3-yl)-phenyl-methanone chloride CAS Name: (1,5-dimethyl-4,6-diphenyl-3-piperidin-1-iumyl)-phenylmethanone chloride IUPAC Name: (1,5-dimethyl-4,6-diphenylpiperidin-1-ium-3-yl)-phenylmethanone chloride Traditional Name: (1,5-dimethyl-4,6-diphenyl-piperidin-1-ium-3-yl)-phenyl-methanone chloride Formula: C26H28ClNO MolecularWeight: 405.95962

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C[NH+](C1C2=CC=CC=C2)C)C(=O)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC1C(C(C[NH+](C1C2=CC=CC=C2)C)C(=O)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C26H27NO.ClH/c1-19-24(20-12-6-3-7-13-20)23(26(28)22-16-10-5-11-17-22)18-27(2)25(19)21-14-8-4-9-15-21;/h3-17,19,23-25H,18H2,1-2H3;1H