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

Systemtic Name: N-(4-butylphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3-nitro-benzamide Openeye Name: N-(4-butylphenyl)-4-methyl-3-nitro-N-(p-tolylsulfonyl)benzamide CAS Name: N-(4-butylphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3-nitrobenzamide IUPAC Name: N-(4-butylphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3-nitrobenzamide Traditional Name: N-(4-butylphenyl)-4-methyl-3-nitro-N-tosyl-benzamide Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=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

CCCCC1=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/C25H26N2O5S/c1-4-5-6-20-10-13-22(14-11-20)26(33(31,32)23-15-7-18(2)8-16-23)25(28)21-12-9-19(3)24(17-21)27(29)30/h7-17H,4-6H2,1-3H3