4-chloranyl-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[[4-(dimethylaminomethyl)phenyl]methyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[4-(dimethylaminomethyl)benzyl]-3-nitro-benzenesulfonamide Formula: C16H18ClN3O4S MolecularWeight: 383.84982

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)CNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H18ClN3O4S/c1-19(2)11-13-5-3-12(4-6-13)10-18-25(23,24)14-7-8-15(17)16(9-14)20(21)22/h3-9,18H,10-11H2,1-2H3