1-heptyl-4-[(1E,5E)-6-(4-propylcyclohexyl)hexa-1,5-dien-3-ynyl]cyclohexane

Systemtic Name: 1-heptyl-4-[(1E,5E)-6-(4-propylcyclohexyl)hexa-1,5-dien-3-ynyl]cyclohexane Openeye Name: 1-heptyl-4-[(1E,5E)-6-(4-propylcyclohexyl)hexa-1,5-dien-3-ynyl]cyclohexane CAS Name: 1-heptyl-4-[(1E,5E)-6-(4-propylcyclohexyl)hexa-1,5-dien-3-ynyl]cyclohexane IUPAC Name: 1-heptyl-4-[(1E,5E)-6-(4-propylcyclohexyl)hexa-1,5-dien-3-ynyl]cyclohexane Traditional Name: 1-heptyl-4-[(1E,5E)-6-(4-propylcyclohexyl)hexa-1,5-dien-3-ynyl]cyclohexane Formula: C28H46 MolecularWeight: 382.66484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C=CC#CC=CC2CCC(CC2)CCC

Isomeric SMILES

CCCCCCCC1CCC(CC1)/C=C/C#C/C=C/C2CCC(CC2)CCC

InChI

InChI=1S/C28H46/c1-3-5-6-7-10-14-27-21-23-28(24-22-27)16-12-9-8-11-15-26-19-17-25(13-4-2)18-20-26/h11-12,15-16,25-28H,3-7,10,13-14,17-24H2,1-2H3/b15-11+,16-12+