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

Systemtic Name: 2-[2-(4-heptylphenyl)ethynyl]-6-pentyl-naphthalene Openeye Name: 2-[2-(4-heptylphenyl)ethynyl]-6-pentyl-naphthalene CAS Name: 2-[2-(4-heptylphenyl)ethynyl]-6-pentylnaphthalene IUPAC Name: 2-[2-(4-heptylphenyl)ethynyl]-6-pentylnaphthalene Traditional Name: 2-amyl-6-[2-(4-heptylphenyl)ethynyl]naphthalene Formula: C30H36 MolecularWeight: 396.60684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H36/c1-3-5-7-8-10-11-25-13-15-26(16-14-25)17-18-28-20-22-29-23-27(12-9-6-4-2)19-21-30(29)24-28/h13-16,19-24H,3-12H2,1-2H3