1-heptyl-4-[(E)-6-(4-propylcyclohexyl)hex-3-en-1,5-diynyl]cyclohexane

Systemtic Name: 1-heptyl-4-[(E)-6-(4-propylcyclohexyl)hex-3-en-1,5-diynyl]cyclohexane Openeye Name: 1-heptyl-4-[(E)-6-(4-propylcyclohexyl)hex-3-en-1,5-diynyl]cyclohexane CAS Name: 1-heptyl-4-[(E)-6-(4-propylcyclohexyl)hex-3-en-1,5-diynyl]cyclohexane IUPAC Name: 1-heptyl-4-[(E)-6-(4-propylcyclohexyl)hex-3-en-1,5-diynyl]cyclohexane Traditional Name: 1-heptyl-4-[(E)-6-(4-propylcyclohexyl)hex-3-en-1,5-diynyl]cyclohexane Formula: C28H44 MolecularWeight: 380.64896

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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#CC2CCC(CC2)CCC

InChI

InChI=1S/C28H44/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/h8-9,25-28H,3-7,10,13-14,17-24H2,1-2H3/b9-8+