methyl-(5-oxidanyl-5,5-diphenyl-pent-2-ynyl)-(phenylmethyl)azanium chloride

Systemtic Name: methyl-(5-oxidanyl-5,5-diphenyl-pent-2-ynyl)-(phenylmethyl)azanium chloride Openeye Name: benzyl-(5-hydroxy-5,5-diphenyl-pent-2-ynyl)-methyl-ammonium chloride CAS Name: (5-hydroxy-5,5-diphenylpent-2-ynyl)-methyl-(phenylmethyl)ammonium chloride IUPAC Name: benzyl-(5-hydroxy-5,5-diphenylpent-2-ynyl)-methylazanium chloride Traditional Name: benzyl-(5-hydroxy-5,5-diphenyl-pent-2-ynyl)-methyl-ammonium chloride Formula: C25H26ClNO MolecularWeight: 391.93304

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC#CCC(C1=CC=CC=C1)(C2=CC=CC=C2)O)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C[NH+](CC#CCC(C1=CC=CC=C1)(C2=CC=CC=C2)O)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C25H25NO.ClH/c1-26(21-22-13-5-2-6-14-22)20-12-11-19-25(27,23-15-7-3-8-16-23)24-17-9-4-10-18-24;/h2-10,13-18,27H,19-21H2,1H3;1H