[(1S)-2-[[2,4-bis(methylsulfonyl)phenyl]amino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[[2,4-bis(methylsulfonyl)phenyl]amino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[2,4-bis(methylsulfonyl)anilino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[2,4-bis(methylsulfonyl)anilino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[2,4-bis(methylsulfonyl)anilino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-(2,4-dimesylanilino)-1-phenyl-ethyl]-dimethyl-ammonium Formula: C18H25N2O4S2+ MolecularWeight: 397.5321

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC1=C(C=C(C=C1)S(=O)(=O)C)S(=O)(=O)C)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC1=C(C=C(C=C1)S(=O)(=O)C)S(=O)(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C18H24N2O4S2/c1-20(2)17(14-8-6-5-7-9-14)13-19-16-11-10-15(25(3,21)22)12-18(16)26(4,23)24/h5-12,17,19H,13H2,1-4H3/p+1/t17-/m1/s1