[4-(2-cyanophenyl)phenyl]methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Openeye Name: [4-(2-cyanophenyl)phenyl]methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium CAS Name: [4-(2-cyanophenyl)phenyl]methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl-methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Traditional Name: [4-(2-cyanophenyl)benzyl]-[(1S)-1-(4-mesylphenyl)ethyl]-methyl-ammonium Formula: C24H25N2O2S+ MolecularWeight: 405.5325

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)[NH+](C)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)C)[NH+](C)CC2=CC=C(C=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C24H24N2O2S/c1-18(20-12-14-23(15-13-20)29(3,27)28)26(2)17-19-8-10-21(11-9-19)24-7-5-4-6-22(24)16-25/h4-15,18H,17H2,1-3H3/p+1/t18-/m0/s1