dimethyl spiro[1,4-dihydropyrazole-5,9'-thioxanthene]-3,4-dicarboxylate

Systemtic Name: dimethyl spiro[1,4-dihydropyrazole-5,9'-thioxanthene]-3,4-dicarboxylate Openeye Name: dimethyl spiro[1,4-dihydropyrazole-5,9'-thioxanthene]-3,4-dicarboxylate CAS Name: spiro[1,4-dihydropyrazole-5,9'-thioxanthene]-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl spiro[1,4-dihydropyrazole-5,9'-thioxanthene]-3,4-dicarboxylate Traditional Name: spiro[2-pyrazoline-5,9'-thioxanthene]-3,4-dicarboxylic acid dimethyl ester Formula: C19H16N2O4S MolecularWeight: 368.40634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=NNC12C3=CC=CC=C3SC4=CC=CC=C24)C(=O)OC

Isomeric SMILES

COC(=O)C1C(=NNC12C3=CC=CC=C3SC4=CC=CC=C24)C(=O)OC

InChI

InChI=1S/C19H16N2O4S/c1-24-17(22)15-16(18(23)25-2)20-21-19(15)11-7-3-5-9-13(11)26-14-10-6-4-8-12(14)19/h3-10,15,21H,1-2H3