N-(4-chlorophenyl)sulfonyl-N-(4-ethoxyphenyl)-4-methyl-3,5-dinitro-benzamide

Systemtic Name: N-(4-chlorophenyl)sulfonyl-N-(4-ethoxyphenyl)-4-methyl-3,5-dinitro-benzamide Openeye Name: N-(4-chlorophenyl)sulfonyl-N-(4-ethoxyphenyl)-4-methyl-3,5-dinitro-benzamide CAS Name: N-(4-chlorophenyl)sulfonyl-N-(4-ethoxyphenyl)-4-methyl-3,5-dinitrobenzamide IUPAC Name: N-(4-chlorophenyl)sulfonyl-N-(4-ethoxyphenyl)-4-methyl-3,5-dinitrobenzamide Traditional Name: N-(4-chlorophenyl)sulfonyl-4-methyl-3,5-dinitro-N-p-phenetyl-benzamide Formula: C22H18ClN3O8S MolecularWeight: 519.91162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H18ClN3O8S/c1-3-34-18-8-6-17(7-9-18)24(35(32,33)19-10-4-16(23)5-11-19)22(27)15-12-20(25(28)29)14(2)21(13-15)26(30)31/h4-13H,3H2,1-2H3