3-chloranyl-6-nitro-2-phenethyl-benzenesulfonamide

Systemtic Name: 3-chloranyl-6-nitro-2-phenethyl-benzenesulfonamide Openeye Name: 3-chloro-6-nitro-2-phenethyl-benzenesulfonamide CAS Name: 3-chloro-6-nitro-2-phenethylbenzenesulfonamide IUPAC Name: 3-chloro-6-nitro-2-phenethylbenzenesulfonamide Traditional Name: 3-chloro-6-nitro-2-phenethyl-benzenesulfonamide Formula: C14H13ClN2O4S MolecularWeight: 340.78202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(C=CC(=C2S(=O)(=O)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(C=CC(=C2S(=O)(=O)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H13ClN2O4S/c15-12-8-9-13(17(18)19)14(22(16,20)21)11(12)7-6-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H2,16,20,21)