N-(4-methoxyphenyl)-4-methyl-3,5-dinitro-N-(phenylsulfonyl)benzamide

Systemtic Name: N-(4-methoxyphenyl)-4-methyl-3,5-dinitro-N-(phenylsulfonyl)benzamide Openeye Name: N-(benzenesulfonyl)-N-(4-methoxyphenyl)-4-methyl-3,5-dinitro-benzamide CAS Name: N-(benzenesulfonyl)-N-(4-methoxyphenyl)-4-methyl-3,5-dinitrobenzamide IUPAC Name: N-(benzenesulfonyl)-N-(4-methoxyphenyl)-4-methyl-3,5-dinitrobenzamide Traditional Name: N-besyl-N-(4-methoxyphenyl)-4-methyl-3,5-dinitro-benzamide Formula: C21H17N3O8S MolecularWeight: 471.43998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O8S/c1-14-19(23(26)27)12-15(13-20(14)24(28)29)21(25)22(16-8-10-17(32-2)11-9-16)33(30,31)18-6-4-3-5-7-18/h3-13H,1-2H3