methyl-(5-oxidanyl-5,5-diphenyl-pent-2-ynyl)-[(1S,2S)-1-oxidanyl-1-phenyl-propan-2-yl]azanium

Systemtic Name: methyl-(5-oxidanyl-5,5-diphenyl-pent-2-ynyl)-[(1S,2S)-1-oxidanyl-1-phenyl-propan-2-yl]azanium Openeye Name: (5-hydroxy-5,5-diphenyl-pent-2-ynyl)-[(1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-methyl-ammonium CAS Name: (5-hydroxy-5,5-diphenylpent-2-ynyl)-[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylammonium IUPAC Name: (5-hydroxy-5,5-diphenylpent-2-ynyl)-[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylazanium Traditional Name: (5-hydroxy-5,5-diphenyl-pent-2-ynyl)-[(1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-methyl-ammonium Formula: C27H30NO2+ MolecularWeight: 400.5326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29NO2/c1-22(26(29)23-14-6-3-7-15-23)28(2)21-13-12-20-27(30,24-16-8-4-9-17-24)25-18-10-5-11-19-25/h3-11,14-19,22,26,29-30H,20-21H2,1-2H3/p+1/t22-,26+/m0/s1