2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-6-heptyl-naphthalene

Systemtic Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-6-heptyl-naphthalene Openeye Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-6-heptyl-naphthalene CAS Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-6-heptylnaphthalene IUPAC Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-6-heptylnaphthalene Traditional Name: 2-[2-[4-(4-ethylcyclohexyl)phenyl]ethynyl]-6-heptyl-naphthalene Formula: C33H40 MolecularWeight: 436.6707

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=C(C=C1)C=C(C=C2)C#CC3=CC=C(C=C3)C4CCC(CC4)CC

Isomeric SMILES

CCCCCCCC1=CC2=C(C=C1)C=C(C=C2)C#CC3=CC=C(C=C3)C4CCC(CC4)CC

InChI

InChI=1S/C33H40/c1-3-5-6-7-8-9-28-16-22-33-25-29(17-23-32(33)24-28)11-10-27-14-20-31(21-15-27)30-18-12-26(4-2)13-19-30/h14-17,20-26,30H,3-9,12-13,18-19H2,1-2H3