[4-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoyl]phenyl]-dimethyl-sulfo-azanium

Systemtic Name: [4-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoyl]phenyl]-dimethyl-sulfo-azanium Openeye Name: [4-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]phenyl]-dimethyl-sulfo-ammonium CAS Name: [4-[[2-chloro-5-(trifluoromethyl)anilino]-oxomethyl]phenyl]-dimethyl-sulfoammonium IUPAC Name: [4-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]phenyl]-dimethyl-sulfoazanium Traditional Name: [4-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]phenyl]-dimethyl-sulfo-ammonium Formula: C16H15ClF3N2O4S+ MolecularWeight: 423.81451

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)O

Isomeric SMILES

C[N+](C)(C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)O

InChI

InChI=1S/C16H14ClF3N2O4S/c1-22(2,27(24,25)26)12-6-3-10(4-7-12)15(23)21-14-9-11(16(18,19)20)5-8-13(14)17/h3-9H,1-2H3,(H-,21,23,24,25,26)/p+1