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

Systemtic Name: (5E)-4-oxidanyl-5-(phenylmethylidene)-4-(3-pyridin-2-ylprop-2-ynyl)cyclopent-2-en-1-one Openeye Name: (5E)-5-benzylidene-4-hydroxy-4-[3-(2-pyridyl)prop-2-ynyl]cyclopent-2-en-1-one CAS Name: (5E)-4-hydroxy-5-(phenylmethylene)-4-[3-(2-pyridinyl)prop-2-ynyl]-1-cyclopent-2-enone IUPAC Name: (5E)-5-benzylidene-4-hydroxy-4-(3-pyridin-2-ylprop-2-ynyl)cyclopent-2-en-1-one Traditional Name: (5E)-5-benzal-4-hydroxy-4-[3-(2-pyridyl)prop-2-ynyl]cyclopent-2-en-1-one Formula: C20H15NO2 MolecularWeight: 301.3386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C2C(=O)C=CC2(CC#CC3=CC=CC=N3)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C\2/C(=O)C=CC2(CC#CC3=CC=CC=N3)O

InChI

InChI=1S/C20H15NO2/c22-19-11-13-20(23,12-6-10-17-9-4-5-14-21-17)18(19)15-16-7-2-1-3-8-16/h1-5,7-9,11,13-15,23H,12H2/b18-15-