N-(2,5-dimethylphenyl)-3,5-dinitro-N-(phenylsulfonyl)benzamide

Systemtic Name: N-(2,5-dimethylphenyl)-3,5-dinitro-N-(phenylsulfonyl)benzamide Openeye Name: N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-3,5-dinitro-benzamide CAS Name: N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-3,5-dinitrobenzamide IUPAC Name: N-(benzenesulfonyl)-N-(2,5-dimethylphenyl)-3,5-dinitrobenzamide Traditional Name: N-besyl-N-(2,5-dimethylphenyl)-3,5-dinitro-benzamide Formula: C21H17N3O7S MolecularWeight: 455.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N(C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)N(C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H17N3O7S/c1-14-8-9-15(2)20(10-14)22(32(30,31)19-6-4-3-5-7-19)21(25)16-11-17(23(26)27)13-18(12-16)24(28)29/h3-13H,1-2H3