1-(5-methyl-4,4-diphenyl-hex-2-ynyl)piperidin-1-ium chloride

Systemtic Name: 1-(5-methyl-4,4-diphenyl-hex-2-ynyl)piperidin-1-ium chloride Openeye Name: 1-(5-methyl-4,4-diphenyl-hex-2-ynyl)piperidin-1-ium chloride CAS Name: 1-(5-methyl-4,4-diphenylhex-2-ynyl)piperidin-1-ium chloride IUPAC Name: 1-(5-methyl-4,4-diphenylhex-2-ynyl)piperidin-1-ium chloride Traditional Name: 1-(5-methyl-4,4-diphenyl-hex-2-ynyl)piperidin-1-ium chloride Formula: C24H30ClN MolecularWeight: 367.9547

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C#CC[NH+]1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC(C)C(C#CC[NH+]1CCCCC1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C24H29N.ClH/c1-21(2)24(22-13-6-3-7-14-22,23-15-8-4-9-16-23)17-12-20-25-18-10-5-11-19-25;/h3-4,6-9,13-16,21H,5,10-11,18-20H2,1-2H3;1H