(5E)-4-[3-(4-chlorophenyl)prop-2-ynyl]-4-oxidanyl-5-(phenylmethylidene)cyclopent-2-en-1-one

Systemtic Name: (5E)-4-[3-(4-chlorophenyl)prop-2-ynyl]-4-oxidanyl-5-(phenylmethylidene)cyclopent-2-en-1-one Openeye Name: (5E)-5-benzylidene-4-[3-(4-chlorophenyl)prop-2-ynyl]-4-hydroxy-cyclopent-2-en-1-one CAS Name: (5E)-4-[3-(4-chlorophenyl)prop-2-ynyl]-4-hydroxy-5-(phenylmethylene)-1-cyclopent-2-enone IUPAC Name: (5E)-5-benzylidene-4-[3-(4-chlorophenyl)prop-2-ynyl]-4-hydroxycyclopent-2-en-1-one Traditional Name: (5E)-5-benzal-4-[3-(4-chlorophenyl)prop-2-ynyl]-4-hydroxy-cyclopent-2-en-1-one Formula: C21H15ClO2 MolecularWeight: 334.7956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C2C(=O)C=CC2(CC#CC3=CC=C(C=C3)Cl)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C\2/C(=O)C=CC2(CC#CC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C21H15ClO2/c22-18-10-8-16(9-11-18)7-4-13-21(24)14-12-20(23)19(21)15-17-5-2-1-3-6-17/h1-3,5-6,8-12,14-15,24H,13H2/b19-15-