4-methyl-2,6-diphenyl-3-propyl-piperidin-1-ium-4-ol chloride

Systemtic Name: 4-methyl-2,6-diphenyl-3-propyl-piperidin-1-ium-4-ol chloride Openeye Name: 4-methyl-2,6-diphenyl-3-propyl-piperidin-1-ium-4-ol chloride CAS Name: 4-methyl-2,6-diphenyl-3-propyl-4-piperidin-1-iumol chloride IUPAC Name: 4-methyl-2,6-diphenyl-3-propylpiperidin-1-ium-4-ol chloride Traditional Name: 4-methyl-2,6-diphenyl-3-propyl-piperidin-1-ium-4-ol chloride Formula: C21H28ClNO MolecularWeight: 345.90612

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C([NH2+]C(CC1(C)O)C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCCC1C([NH2+]C(CC1(C)O)C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C21H27NO.ClH/c1-3-10-18-20(17-13-8-5-9-14-17)22-19(15-21(18,2)23)16-11-6-4-7-12-16;/h4-9,11-14,18-20,22-23H,3,10,15H2,1-2H3;1H