4-(benzotriazol-1-yl)-N-(2-chlorophenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-(benzotriazol-1-yl)-N-(2-chlorophenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-(benzotriazol-1-yl)-N-(2-chlorophenyl)-3-nitro-benzenesulfonamide CAS Name: 4-(1-benzotriazolyl)-N-(2-chlorophenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-(benzotriazol-1-yl)-N-(2-chlorophenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-(benzotriazol-1-yl)-N-(2-chlorophenyl)-3-nitro-benzenesulfonamide Formula: C18H12ClN5O4S MolecularWeight: 429.83698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=C(C=C(C=C3)S(=O)(=O)NC4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H12ClN5O4S/c19-13-5-1-2-6-14(13)21-29(27,28)12-9-10-17(18(11-12)24(25)26)23-16-8-4-3-7-15(16)20-22-23/h1-11,21H