methyl 4-[(E)-[2-oxidanyl-5-oxidanylidene-2-(3-thiophen-2-ylprop-2-ynyl)cyclopent-3-en-1-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[(E)-[2-oxidanyl-5-oxidanylidene-2-(3-thiophen-2-ylprop-2-ynyl)cyclopent-3-en-1-ylidene]methyl]benzoate Openeye Name: methyl 4-[(E)-[2-hydroxy-5-oxo-2-[3-(2-thienyl)prop-2-ynyl]cyclopent-3-en-1-ylidene]methyl]benzoate CAS Name: 4-[(E)-[2-hydroxy-5-oxo-2-(3-thiophen-2-ylprop-2-ynyl)-1-cyclopent-3-enylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[2-hydroxy-5-oxo-2-(3-thiophen-2-ylprop-2-ynyl)cyclopent-3-en-1-ylidene]methyl]benzoate Traditional Name: 4-[(E)-[2-hydroxy-5-keto-2-[3-(2-thienyl)prop-2-ynyl]cyclopent-3-en-1-ylidene]methyl]benzoic acid methyl ester Formula: C21H16O4S MolecularWeight: 364.41434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)C=CC2(CC#CC3=CC=CS3)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)C=CC2(CC#CC3=CC=CS3)O

InChI

InChI=1S/C21H16O4S/c1-25-20(23)16-8-6-15(7-9-16)14-18-19(22)10-12-21(18,24)11-2-4-17-5-3-13-26-17/h3,5-10,12-14,24H,11H2,1H3/b18-14-