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

Systemtic Name: N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-4-methyl-3,5-dinitro-benzamide Openeye Name: N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-4-methyl-3,5-dinitro-benzamide CAS Name: N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-4-methyl-3,5-dinitrobenzamide IUPAC Name: N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-4-methyl-3,5-dinitrobenzamide Traditional Name: N-(4-butylphenyl)-N-(4-chlorophenyl)sulfonyl-4-methyl-3,5-dinitro-benzamide Formula: C24H22ClN3O7S MolecularWeight: 531.96538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=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

CCCCC1=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/C24H22ClN3O7S/c1-3-4-5-17-6-10-20(11-7-17)26(36(34,35)21-12-8-19(25)9-13-21)24(29)18-14-22(27(30)31)16(2)23(15-18)28(32)33/h6-15H,3-5H2,1-2H3