(3-methylphenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium

Systemtic Name: (3-methylphenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Openeye Name: [(1S)-1-(4-methylsulfonylphenyl)ethyl]-(m-tolylmethyl)ammonium CAS Name: (3-methylphenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]ammonium IUPAC Name: (3-methylphenyl)methyl-[(1S)-1-(4-methylsulfonylphenyl)ethyl]azanium Traditional Name: [(1S)-1-(4-mesylphenyl)ethyl]-(3-methylbenzyl)ammonium Formula: C17H22NO2S+ MolecularWeight: 304.42708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH2+]C(C)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)C[NH2+][C@@H](C)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H21NO2S/c1-13-5-4-6-15(11-13)12-18-14(2)16-7-9-17(10-8-16)21(3,19)20/h4-11,14,18H,12H2,1-3H3/p+1/t14-/m0/s1