[2-chloranyl-5-[2-(dimethylcarbamoyl)phenyl]sulfanyl-4-nitro-phenyl]-trimethyl-azanium

Systemtic Name: [2-chloranyl-5-[2-(dimethylcarbamoyl)phenyl]sulfanyl-4-nitro-phenyl]-trimethyl-azanium Openeye Name: [2-chloro-5-[2-(dimethylcarbamoyl)phenyl]sulfanyl-4-nitro-phenyl]-trimethyl-ammonium CAS Name: [2-chloro-5-[[2-[dimethylamino(oxo)methyl]phenyl]thio]-4-nitrophenyl]-trimethylammonium IUPAC Name: [2-chloro-5-[2-(dimethylcarbamoyl)phenyl]sulfanyl-4-nitrophenyl]-trimethylazanium Traditional Name: [2-chloro-5-[[2-(dimethylcarbamoyl)phenyl]thio]-4-nitro-phenyl]-trimethyl-ammonium Formula: C18H21ClN3O3S+ MolecularWeight: 394.89564

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=CC=C1SC2=CC(=C(C=C2[N+](=O)[O-])Cl)[N+](C)(C)C

Isomeric SMILES

CN(C)C(=O)C1=CC=CC=C1SC2=CC(=C(C=C2[N+](=O)[O-])Cl)[N+](C)(C)C

InChI

InChI=1S/C18H21ClN3O3S/c1-20(2)18(23)12-8-6-7-9-16(12)26-17-11-15(22(3,4)5)13(19)10-14(17)21(24)25/h6-11H,1-5H3/q+1