[(1S,2R)-3-methyl-1-phenyl-1-(phenylsulfonyl)butan-2-yl]-bis(phenylmethyl)azanium

Systemtic Name: [(1S,2R)-3-methyl-1-phenyl-1-(phenylsulfonyl)butan-2-yl]-bis(phenylmethyl)azanium Openeye Name: [(1R)-1-[(S)-benzenesulfonyl(phenyl)methyl]-2-methyl-propyl]-dibenzyl-ammonium CAS Name: [(1S,2R)-1-(benzenesulfonyl)-3-methyl-1-phenylbutan-2-yl]-bis(phenylmethyl)ammonium IUPAC Name: [(1S,2R)-1-(benzenesulfonyl)-3-methyl-1-phenylbutan-2-yl]-dibenzylazanium Traditional Name: dibenzyl-[(1R)-1-[(S)-besyl(phenyl)methyl]-2-methyl-propyl]ammonium Formula: C31H34NO2S+ MolecularWeight: 484.67216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)[NH+](CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)[C@H]([C@H](C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)[NH+](CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C31H33NO2S/c1-25(2)30(32(23-26-15-7-3-8-16-26)24-27-17-9-4-10-18-27)31(28-19-11-5-12-20-28)35(33,34)29-21-13-6-14-22-29/h3-22,25,30-31H,23-24H2,1-2H3/p+1/t30-,31+/m1/s1