1,3,5-trimethyl-2,6-diphenyl-4-(phenylmethyl)piperidin-1-ium-4-ol chloride

Systemtic Name: 1,3,5-trimethyl-2,6-diphenyl-4-(phenylmethyl)piperidin-1-ium-4-ol chloride Openeye Name: 4-benzyl-1,3,5-trimethyl-2,6-diphenyl-piperidin-1-ium-4-ol chloride CAS Name: 1,3,5-trimethyl-2,6-diphenyl-4-(phenylmethyl)-4-piperidin-1-iumol chloride IUPAC Name: 4-benzyl-1,3,5-trimethyl-2,6-diphenylpiperidin-1-ium-4-ol chloride Traditional Name: 4-benzyl-1,3,5-trimethyl-2,6-diphenyl-piperidin-1-ium-4-ol chloride Formula: C27H32ClNO MolecularWeight: 422.00208

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Descriptors Computed from Structure

Canonical SMILES:

CC1C([NH+](C(C(C1(CC2=CC=CC=C2)O)C)C3=CC=CC=C3)C)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC1C([NH+](C(C(C1(CC2=CC=CC=C2)O)C)C3=CC=CC=C3)C)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C27H31NO.ClH/c1-20-25(23-15-9-5-10-16-23)28(3)26(24-17-11-6-12-18-24)21(2)27(20,29)19-22-13-7-4-8-14-22;/h4-18,20-21,25-26,29H,19H2,1-3H3;1H