4-[(3-chlorophenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(3-chlorophenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[(3-chlorophenyl)methyl-methyl-amino]-3-nitro-benzenesulfonamide CAS Name: 4-[(3-chlorophenyl)methyl-methylamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(3-chlorophenyl)methyl-methylamino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(3-chlorobenzyl)-methyl-amino]-3-nitro-benzenesulfonamide Formula: C14H14ClN3O4S MolecularWeight: 355.79666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14ClN3O4S/c1-17(9-10-3-2-4-11(15)7-10)13-6-5-12(23(16,21)22)8-14(13)18(19)20/h2-8H,9H2,1H3,(H2,16,21,22)