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

Systemtic Name: 2-[2-(4-heptoxyphenyl)ethynyl]-6-pentyl-naphthalene Openeye Name: 2-[2-(4-heptoxyphenyl)ethynyl]-6-pentyl-naphthalene CAS Name: 2-[2-(4-heptoxyphenyl)ethynyl]-6-pentylnaphthalene IUPAC Name: 2-[2-(4-heptoxyphenyl)ethynyl]-6-pentylnaphthalene Traditional Name: 2-amyl-6-[2-(4-heptoxyphenyl)ethynyl]naphthalene Formula: C30H36O MolecularWeight: 412.60624

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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)CCCCC

Isomeric SMILES

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

InChI

InChI=1S/C30H36O/c1-3-5-7-8-10-22-31-30-20-16-25(17-21-30)12-13-27-15-19-28-23-26(11-9-6-4-2)14-18-29(28)24-27/h14-21,23-24H,3-11,22H2,1-2H3