[[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-phenyl]carbonylamino]methylidene-dimethyl-azanium

Systemtic Name: [[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-phenyl]carbonylamino]methylidene-dimethyl-azanium Openeye Name: [[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-benzoyl]amino]methylene-dimethyl-ammonium CAS Name: [[[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrophenyl]-oxomethyl]amino]methylidene-dimethylammonium IUPAC Name: [[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitrobenzoyl]amino]methylidene-dimethylazanium Traditional Name: [[3-[(4-chlorophenyl)sulfonylmethyl]-4-nitro-benzoyl]amino]methylene-dimethyl-ammonium Formula: C17H17ClN3O5S+ MolecularWeight: 410.85198

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=CNC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])CS(=O)(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

C[N+](=CNC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])CS(=O)(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C17H16ClN3O5S/c1-20(2)11-19-17(22)12-3-8-16(21(23)24)13(9-12)10-27(25,26)15-6-4-14(18)5-7-15/h3-9,11H,10H2,1-2H3/p+1