N-(4-ethylphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3-nitro-benzamide

Systemtic Name: N-(4-ethylphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3-nitro-benzamide Openeye Name: N-(4-ethylphenyl)-4-methyl-3-nitro-N-(p-tolylsulfonyl)benzamide CAS Name: N-(4-ethylphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3-nitrobenzamide IUPAC Name: N-(4-ethylphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3-nitrobenzamide Traditional Name: N-(4-ethylphenyl)-4-methyl-3-nitro-N-tosyl-benzamide Formula: C23H22N2O5S MolecularWeight: 438.49618

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H22N2O5S/c1-4-18-8-11-20(12-9-18)24(31(29,30)21-13-5-16(2)6-14-21)23(26)19-10-7-17(3)22(15-19)25(27)28/h5-15H,4H2,1-3H3