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

Systemtic Name: N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-4-chloranyl-N-(4-ethoxyphenyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-N-(4-ethoxyphenyl)-3-nitro-benzamide CAS Name: 4-chloro-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-N-(4-ethoxyphenyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-N-(4-ethoxyphenyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(1,1-diketo-2,3-dihydrothiophen-3-yl)-3-nitro-N-p-phenetyl-benzamide Formula: C19H17ClN2O6S MolecularWeight: 436.86608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C2CS(=O)(=O)C=C2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C2CS(=O)(=O)C=C2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H17ClN2O6S/c1-2-28-16-6-4-14(5-7-16)21(15-9-10-29(26,27)12-15)19(23)13-3-8-17(20)18(11-13)22(24)25/h3-11,15H,2,12H2,1H3