3-methyl-4-nonyl-2,6-diphenyl-5-propyl-piperidin-1-ium-4-ol chloride

Systemtic Name: 3-methyl-4-nonyl-2,6-diphenyl-5-propyl-piperidin-1-ium-4-ol chloride Openeye Name: 3-methyl-4-nonyl-2,6-diphenyl-5-propyl-piperidin-1-ium-4-ol chloride CAS Name: 3-methyl-4-nonyl-2,6-diphenyl-5-propyl-4-piperidin-1-iumol chloride IUPAC Name: 3-methyl-4-nonyl-2,6-diphenyl-5-propylpiperidin-1-ium-4-ol chloride Traditional Name: 3-methyl-4-nonyl-2,6-diphenyl-5-propyl-piperidin-1-ium-4-ol chloride Formula: C30H46ClNO MolecularWeight: 472.14534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1(C(C([NH2+]C(C1CCC)C2=CC=CC=C2)C3=CC=CC=C3)C)O.[Cl-]

Isomeric SMILES

CCCCCCCCCC1(C(C([NH2+]C(C1CCC)C2=CC=CC=C2)C3=CC=CC=C3)C)O.[Cl-]

InChI

InChI=1S/C30H45NO.ClH/c1-4-6-7-8-9-10-17-23-30(32)24(3)28(25-19-13-11-14-20-25)31-29(27(30)18-5-2)26-21-15-12-16-22-26;/h11-16,19-22,24,27-29,31-32H,4-10,17-18,23H2,1-3H3;1H