4-[(2-chlorophenyl)methylamino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2-chlorophenyl)methylamino]-3-nitro-benzenesulfonamide Openeye Name: 4-[(2-chlorophenyl)methylamino]-3-nitro-benzenesulfonamide CAS Name: 4-[(2-chlorophenyl)methylamino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2-chlorophenyl)methylamino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(2-chlorobenzyl)amino]-3-nitro-benzenesulfonamide Formula: C13H12ClN3O4S MolecularWeight: 341.77008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H12ClN3O4S/c14-11-4-2-1-3-9(11)8-16-12-6-5-10(22(15,20)21)7-13(12)17(18)19/h1-7,16H,8H2,(H2,15,20,21)