2-[2-(4-heptoxyphenyl)ethynyl]-6-hexyl-naphthalene

Systemtic Name: 2-[2-(4-heptoxyphenyl)ethynyl]-6-hexyl-naphthalene Openeye Name: 2-[2-(4-heptoxyphenyl)ethynyl]-6-hexyl-naphthalene CAS Name: 2-[2-(4-heptoxyphenyl)ethynyl]-6-hexylnaphthalene IUPAC Name: 2-[2-(4-heptoxyphenyl)ethynyl]-6-hexylnaphthalene Traditional Name: 2-[2-(4-heptoxyphenyl)ethynyl]-6-hexyl-naphthalene Formula: C31H38O MolecularWeight: 426.63282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C=C(C=C3)CCCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C=C(C=C3)CCCCCC

InChI

InChI=1S/C31H38O/c1-3-5-7-9-11-23-32-31-21-17-26(18-22-31)13-14-28-16-20-29-24-27(12-10-8-6-4-2)15-19-30(29)25-28/h15-22,24-25H,3-12,23H2,1-2H3