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

Systemtic Name: tert-butyl-(5-oxidanyl-5,5-diphenyl-pent-2-ynyl)-(phenylmethyl)azanium Openeye Name: benzyl-tert-butyl-(5-hydroxy-5,5-diphenyl-pent-2-ynyl)ammonium CAS Name: tert-butyl-(5-hydroxy-5,5-diphenylpent-2-ynyl)-(phenylmethyl)ammonium IUPAC Name: benzyl-tert-butyl-(5-hydroxy-5,5-diphenylpent-2-ynyl)azanium Traditional Name: benzyl-tert-butyl-(5-hydroxy-5,5-diphenyl-pent-2-ynyl)ammonium Formula: C28H32NO+ MolecularWeight: 398.55978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31NO/c1-27(2,3)29(23-24-15-7-4-8-16-24)22-14-13-21-28(30,25-17-9-5-10-18-25)26-19-11-6-12-20-26/h4-12,15-20,30H,21-23H2,1-3H3/p+1