(4-tert-butylphenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Openeye Name: (4-tert-butylphenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium CAS Name: (4-tert-butylphenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium IUPAC Name: (4-tert-butylphenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Traditional Name: (4-tert-butylbenzyl)-[(1S)-1-(4-mesylphenyl)ethyl]ammonium Formula: C20H28NO2S+ MolecularWeight: 346.50682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)[NH2+]CC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)S(=O)(=O)C)[NH2+]CC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H27NO2S/c1-15(17-8-12-19(13-9-17)24(5,22)23)21-14-16-6-10-18(11-7-16)20(2,3)4/h6-13,15,21H,14H2,1-5H3/p+1/t15-/m0/s1