4-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide CAS Name: 4-[(2-chloro-6-fluorophenyl)methyl-methylamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methyl-methylamino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(2-chloro-6-fluoro-benzyl)-methyl-amino]-3-nitro-benzenesulfonamide Formula: C14H13ClFN3O4S MolecularWeight: 373.787123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)C2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H13ClFN3O4S/c1-18(8-10-11(15)3-2-4-12(10)16)13-6-5-9(24(17,22)23)7-14(13)19(20)21/h2-7H,8H2,1H3,(H2,17,22,23)