methyl 2-methyl-4-(2-nitrophenyl)-5,5-bis(oxidanylidene)-1,4-dihydro-[1]benzothiolo[3,2-b]pyridine-3-carboxylate

Systemtic Name: methyl 2-methyl-4-(2-nitrophenyl)-5,5-bis(oxidanylidene)-1,4-dihydro-[1]benzothiolo[3,2-b]pyridine-3-carboxylate Openeye Name: methyl 2-methyl-4-(2-nitrophenyl)-5,5-dioxo-1,4-dihydrobenzothiopheno[3,2-b]pyridine-3-carboxylate CAS Name: 2-methyl-4-(2-nitrophenyl)-5,5-dioxo-1,4-dihydro-[1]benzothiolo[3,2-b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-methyl-4-(2-nitrophenyl)-5,5-dioxo-1,4-dihydro-[1]benzothiolo[3,2-b]pyridine-3-carboxylate Traditional Name: 5,5-diketo-2-methyl-4-(2-nitrophenyl)-1,4-dihydrobenzothiopheno[3,2-b]pyridine-3-carboxylic acid methyl ester Formula: C20H16N2O6S MolecularWeight: 412.41584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)C3=CC=CC=C3S2(=O)=O)C4=CC=CC=C4[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)C3=CC=CC=C3S2(=O)=O)C4=CC=CC=C4[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C20H16N2O6S/c1-11-16(20(23)28-2)17(12-7-3-5-9-14(12)22(24)25)19-18(21-11)13-8-4-6-10-15(13)29(19,26)27/h3-10,17,21H,1-2H3