N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-N-(3,4-dimethylphenyl)-3-nitro-benzamide

Systemtic Name: N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-N-(3,4-dimethylphenyl)-3-nitro-benzamide Openeye Name: N-(3,4-dimethylphenyl)-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-3-nitro-benzamide CAS Name: N-(3,4-dimethylphenyl)-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-3-nitrobenzamide IUPAC Name: N-(3,4-dimethylphenyl)-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-3-nitrobenzamide Traditional Name: N-(1,1-diketo-2,3-dihydrothiophen-3-yl)-N-(3,4-dimethylphenyl)-3-nitro-benzamide Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(C2CS(=O)(=O)C=C2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)N(C2CS(=O)(=O)C=C2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H18N2O5S/c1-13-6-7-16(10-14(13)2)20(18-8-9-27(25,26)12-18)19(22)15-4-3-5-17(11-15)21(23)24/h3-11,18H,12H2,1-2H3