(4Z)-2-heptyl-4-[(3-heptyl-5-octyl-4-oxidanyl-phenyl)methylidene]-6-octyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-2-heptyl-4-[(3-heptyl-5-octyl-4-oxidanyl-phenyl)methylidene]-6-octyl-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-2-heptyl-4-[(3-heptyl-4-hydroxy-5-octyl-phenyl)methylene]-6-octyl-cyclohexa-2,5-dien-1-one CAS Name: (4Z)-2-heptyl-4-[(3-heptyl-4-hydroxy-5-octylphenyl)methylidene]-6-octyl-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-2-heptyl-4-[(3-heptyl-4-hydroxy-5-octylphenyl)methylidene]-6-octylcyclohexa-2,5-dien-1-one Traditional Name: (4Z)-2-heptyl-4-(3-heptyl-4-hydroxy-5-octyl-benzylidene)-6-octyl-cyclohexa-2,5-dien-1-one Formula: C43H70O2 MolecularWeight: 619.0147

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=CC(=C1O)CCCCCCC)C=C2C=C(C(=O)C(=C2)CCCCCCCC)CCCCCCC

Isomeric SMILES

CCCCCCCCC1=CC(=CC(=C1O)CCCCCCC)/C=C\2/C=C(C(=O)C(=C2)CCCCCCCC)CCCCCCC

InChI

InChI=1S/C43H70O2/c1-5-9-13-17-21-25-29-40-34-36(32-38(42(40)44)27-23-19-15-11-7-3)31-37-33-39(28-24-20-16-12-8-4)43(45)41(35-37)30-26-22-18-14-10-6-2/h31-35,44H,5-30H2,1-4H3/b37-31-