3-methyl-2-[(3E,7Z)-7-methyl-12-phenyl-dodeca-3,7-dien-11-ynyl]cyclopent-2-en-1-one

Systemtic Name: 3-methyl-2-[(3E,7Z)-7-methyl-12-phenyl-dodeca-3,7-dien-11-ynyl]cyclopent-2-en-1-one Openeye Name: 3-methyl-2-[(3E,7Z)-7-methyl-12-phenyl-dodeca-3,7-dien-11-ynyl]cyclopent-2-en-1-one CAS Name: 3-methyl-2-[(3E,7Z)-7-methyl-12-phenyldodeca-3,7-dien-11-ynyl]-1-cyclopent-2-enone IUPAC Name: 3-methyl-2-[(3E,7Z)-7-methyl-12-phenyldodeca-3,7-dien-11-ynyl]cyclopent-2-en-1-one Traditional Name: 3-methyl-2-[(3E,7Z)-7-methyl-12-phenyl-dodeca-3,7-dien-11-ynyl]cyclopent-2-en-1-one Formula: C25H30O MolecularWeight: 346.5051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)CC1)CCC=CCCC(=CCCC#CC2=CC=CC=C2)C

Isomeric SMILES

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

InChI

InChI=1S/C25H30O/c1-21(14-8-5-9-15-23-16-10-6-11-17-23)13-7-3-4-12-18-24-22(2)19-20-25(24)26/h3-4,6,10-11,14,16-17H,5,7-8,12-13,18-20H2,1-2H3/b4-3+,21-14-