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

Systemtic Name: N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]-4-chloranyl-N-(3-methylphenyl)-3-nitro-benzamide Openeye Name: 4-chloro-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-N-(m-tolyl)-3-nitro-benzamide CAS Name: 4-chloro-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-N-(3-methylphenyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-N-(3-methylphenyl)-3-nitrobenzamide Traditional Name: 4-chloro-N-(1,1-diketo-2,3-dihydrothiophen-3-yl)-N-(m-tolyl)-3-nitro-benzamide Formula: C18H15ClN2O5S MolecularWeight: 406.8401

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN2O5S/c1-12-3-2-4-14(9-12)20(15-7-8-27(25,26)11-15)18(22)13-5-6-16(19)17(10-13)21(23)24/h2-10,15H,11H2,1H3