dimethyl-[(1S)-2-[(2-methyl-5-methylsulfonyl-phenyl)carbonylamino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[(2-methyl-5-methylsulfonyl-phenyl)carbonylamino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[(2-methyl-5-methylsulfonyl-benzoyl)amino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[(2-methyl-5-methylsulfonylphenyl)-oxomethyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[(2-methyl-5-methylsulfonylbenzoyl)amino]-1-phenylethyl]azanium Traditional Name: [(1S)-2-[(5-mesyl-2-methyl-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C19H25N2O3S+ MolecularWeight: 361.4784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O3S/c1-14-10-11-16(25(4,23)24)12-17(14)19(22)20-13-18(21(2)3)15-8-6-5-7-9-15/h5-12,18H,13H2,1-4H3,(H,20,22)/p+1/t18-/m1/s1