N-(4-ethoxyphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3,5-dinitro-benzamide

Systemtic Name: N-(4-ethoxyphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3,5-dinitro-benzamide Openeye Name: N-(4-ethoxyphenyl)-4-methyl-3,5-dinitro-N-(p-tolylsulfonyl)benzamide CAS Name: N-(4-ethoxyphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3,5-dinitrobenzamide IUPAC Name: N-(4-ethoxyphenyl)-4-methyl-N-(4-methylphenyl)sulfonyl-3,5-dinitrobenzamide Traditional Name: 4-methyl-3,5-dinitro-N-p-phenetyl-N-tosyl-benzamide Formula: C23H21N3O8S MolecularWeight: 499.49314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=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)C

Isomeric SMILES

CCOC1=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)C

InChI

InChI=1S/C23H21N3O8S/c1-4-34-19-9-7-18(8-10-19)24(35(32,33)20-11-5-15(2)6-12-20)23(27)17-13-21(25(28)29)16(3)22(14-17)26(30)31/h5-14H,4H2,1-3H3