ethyl 4-[3-[(5E)-5-(3-methylbut-2-enylidene)-1-oxidanyl-4-oxidanylidene-cyclopent-2-en-1-yl]prop-1-ynyl]benzoate

Systemtic Name: ethyl 4-[3-[(5E)-5-(3-methylbut-2-enylidene)-1-oxidanyl-4-oxidanylidene-cyclopent-2-en-1-yl]prop-1-ynyl]benzoate Openeye Name: ethyl 4-[3-[(5E)-1-hydroxy-5-(3-methylbut-2-enylidene)-4-oxo-cyclopent-2-en-1-yl]prop-1-ynyl]benzoate CAS Name: 4-[3-[(5E)-1-hydroxy-5-(3-methylbut-2-enylidene)-4-oxo-1-cyclopent-2-enyl]prop-1-ynyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[(5E)-1-hydroxy-5-(3-methylbut-2-enylidene)-4-oxocyclopent-2-en-1-yl]prop-1-ynyl]benzoate Traditional Name: 4-[3-[(5E)-1-hydroxy-4-keto-5-(3-methylbut-2-enylidene)cyclopent-2-en-1-yl]prop-1-ynyl]benzoic acid ethyl ester Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C#CCC2(C=CC(=O)C2=CC=C(C)C)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C#CCC\2(C=CC(=O)/C2=C/C=C(C)C)O

InChI

InChI=1S/C22H22O4/c1-4-26-21(24)18-10-8-17(9-11-18)6-5-14-22(25)15-13-20(23)19(22)12-7-16(2)3/h7-13,15,25H,4,14H2,1-3H3/b19-12-