N-(4-butylphenyl)-4-chloranyl-N-(4-methylphenyl)sulfonyl-3-nitro-benzamide

Systemtic Name: N-(4-butylphenyl)-4-chloranyl-N-(4-methylphenyl)sulfonyl-3-nitro-benzamide Openeye Name: N-(4-butylphenyl)-4-chloro-3-nitro-N-(p-tolylsulfonyl)benzamide CAS Name: N-(4-butylphenyl)-4-chloro-N-(4-methylphenyl)sulfonyl-3-nitrobenzamide IUPAC Name: N-(4-butylphenyl)-4-chloro-N-(4-methylphenyl)sulfonyl-3-nitrobenzamide Traditional Name: N-(4-butylphenyl)-4-chloro-3-nitro-N-tosyl-benzamide Formula: C24H23ClN2O5S MolecularWeight: 486.96782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N(C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N(C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H23ClN2O5S/c1-3-4-5-18-8-11-20(12-9-18)26(33(31,32)21-13-6-17(2)7-14-21)24(28)19-10-15-22(25)23(16-19)27(29)30/h6-16H,3-5H2,1-2H3