2-[2-(4-hexylphenyl)ethynyl]-6-pentoxy-naphthalene

Systemtic Name: 2-[2-(4-hexylphenyl)ethynyl]-6-pentoxy-naphthalene Openeye Name: 2-[2-(4-hexylphenyl)ethynyl]-6-pentoxy-naphthalene CAS Name: 2-[2-(4-hexylphenyl)ethynyl]-6-pentoxynaphthalene IUPAC Name: 2-[2-(4-hexylphenyl)ethynyl]-6-pentoxynaphthalene Traditional Name: 2-amoxy-6-[2-(4-hexylphenyl)ethynyl]naphthalene Formula: C29H34O MolecularWeight: 398.57966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C=C(C=C3)OCCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C#CC2=CC3=C(C=C2)C=C(C=C3)OCCCCC

InChI

InChI=1S/C29H34O/c1-3-5-7-8-10-24-11-13-25(14-12-24)15-16-26-17-18-28-23-29(20-19-27(28)22-26)30-21-9-6-4-2/h11-14,17-20,22-23H,3-10,21H2,1-2H3