2-hydroxyethyl-(4-oxidanyl-4,4-diphenyl-but-2-ynyl)-propan-2-yl-azanium

Systemtic Name: 2-hydroxyethyl-(4-oxidanyl-4,4-diphenyl-but-2-ynyl)-propan-2-yl-azanium Openeye Name: (4-hydroxy-4,4-diphenyl-but-2-ynyl)-(2-hydroxyethyl)-isopropyl-ammonium CAS Name: (4-hydroxy-4,4-diphenylbut-2-ynyl)-(2-hydroxyethyl)-propan-2-ylammonium IUPAC Name: (4-hydroxy-4,4-diphenylbut-2-ynyl)-(2-hydroxyethyl)-propan-2-ylazanium Traditional Name: (4-hydroxy-4,4-diphenyl-but-2-ynyl)-(2-hydroxyethyl)-isopropyl-ammonium Formula: C21H26NO2+ MolecularWeight: 324.43664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCO)CC#CC(C1=CC=CC=C1)(C2=CC=CC=C2)O

Isomeric SMILES

CC(C)[NH+](CCO)CC#CC(C1=CC=CC=C1)(C2=CC=CC=C2)O

InChI

InChI=1S/C21H25NO2/c1-18(2)22(16-17-23)15-9-14-21(24,19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-8,10-13,18,23-24H,15-17H2,1-2H3/p+1