(5E)-5-(3-methylbut-2-enylidene)-4-oxidanyl-4-(3-pyridin-3-ylprop-2-ynyl)cyclopent-2-en-1-one

Systemtic Name: (5E)-5-(3-methylbut-2-enylidene)-4-oxidanyl-4-(3-pyridin-3-ylprop-2-ynyl)cyclopent-2-en-1-one Openeye Name: (5E)-4-hydroxy-5-(3-methylbut-2-enylidene)-4-[3-(3-pyridyl)prop-2-ynyl]cyclopent-2-en-1-one CAS Name: (5E)-4-hydroxy-5-(3-methylbut-2-enylidene)-4-[3-(3-pyridinyl)prop-2-ynyl]-1-cyclopent-2-enone IUPAC Name: (5E)-4-hydroxy-5-(3-methylbut-2-enylidene)-4-(3-pyridin-3-ylprop-2-ynyl)cyclopent-2-en-1-one Traditional Name: (5E)-4-hydroxy-5-(3-methylbut-2-enylidene)-4-[3-(3-pyridyl)prop-2-ynyl]cyclopent-2-en-1-one Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=C1C(=O)C=CC1(CC#CC2=CN=CC=C2)O)C

Isomeric SMILES

CC(=C/C=C\1/C(=O)C=CC1(CC#CC2=CN=CC=C2)O)C

InChI

InChI=1S/C18H17NO2/c1-14(2)7-8-16-17(20)9-11-18(16,21)10-3-5-15-6-4-12-19-13-15/h4,6-9,11-13,21H,10H2,1-2H3/b16-8-