N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)-3,5-dinitro-benzamide

Systemtic Name: N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)-3,5-dinitro-benzamide Openeye Name: N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)-3,5-dinitro-benzamide CAS Name: N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)-3,5-dinitrobenzamide IUPAC Name: N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)-3,5-dinitrobenzamide Traditional Name: N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)-3,5-dinitro-benzamide Formula: C21H16ClN3O7S MolecularWeight: 489.88564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H16ClN3O7S/c1-13-3-4-14(2)20(9-13)23(33(31,32)19-7-5-16(22)6-8-19)21(26)15-10-17(24(27)28)12-18(11-15)25(29)30/h3-12H,1-2H3