[(2S,3S)-3-(4-ethoxyphenyl)-3-oxidanyl-2,4-diphenyl-butyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [(2S,3S)-3-(4-ethoxyphenyl)-3-oxidanyl-2,4-diphenyl-butyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[(2S,3S)-3-(4-ethoxyphenyl)-3-hydroxy-2,4-diphenyl-butyl]-methyl-ammonium CAS Name: [(2S,3S)-3-(4-ethoxyphenyl)-3-hydroxy-2,4-diphenylbutyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2S,3S)-3-(4-ethoxyphenyl)-3-hydroxy-2,4-diphenylbutyl]-methylazanium Traditional Name: benzyl-[(2S,3S)-3-hydroxy-2,4-diphenyl-3-p-phenetyl-butyl]-methyl-ammonium Formula: C32H36NO2+ MolecularWeight: 466.63374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CC2=CC=CC=C2)(C(C[NH+](C)CC3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@](CC2=CC=CC=C2)([C@H](C[NH+](C)CC3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C32H35NO2/c1-3-35-30-21-19-29(20-22-30)32(34,23-26-13-7-4-8-14-26)31(28-17-11-6-12-18-28)25-33(2)24-27-15-9-5-10-16-27/h4-22,31,34H,3,23-25H2,1-2H3/p+1/t31-,32-/m1/s1