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

Systemtic Name: 2-hydroxyethyl-(5-oxidanyl-5,5-diphenyl-pent-2-ynyl)-(phenylmethyl)azanium Openeye Name: benzyl-(5-hydroxy-5,5-diphenyl-pent-2-ynyl)-(2-hydroxyethyl)ammonium CAS Name: (5-hydroxy-5,5-diphenylpent-2-ynyl)-(2-hydroxyethyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-(5-hydroxy-5,5-diphenylpent-2-ynyl)-(2-hydroxyethyl)azanium Traditional Name: benzyl-(5-hydroxy-5,5-diphenyl-pent-2-ynyl)-(2-hydroxyethyl)ammonium Formula: C26H28NO2+ MolecularWeight: 386.50602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH+](CCO)CC#CCC(C2=CC=CC=C2)(C3=CC=CC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)C[NH+](CCO)CC#CCC(C2=CC=CC=C2)(C3=CC=CC=C3)O

InChI

InChI=1S/C26H27NO2/c28-21-20-27(22-23-12-4-1-5-13-23)19-11-10-18-26(29,24-14-6-2-7-15-24)25-16-8-3-9-17-25/h1-9,12-17,28-29H,18-22H2/p+1