1-methoxy-4-[4-[2-(4-pent-2-ynylphenyl)ethynyl]phenyl]benzene

Systemtic Name: 1-methoxy-4-[4-[2-(4-pent-2-ynylphenyl)ethynyl]phenyl]benzene Openeye Name: 1-methoxy-4-[4-[2-(4-pent-2-ynylphenyl)ethynyl]phenyl]benzene CAS Name: 1-methoxy-4-[4-[2-(4-pent-2-ynylphenyl)ethynyl]phenyl]benzene IUPAC Name: 1-methoxy-4-[4-[2-(4-pent-2-ynylphenyl)ethynyl]phenyl]benzene Traditional Name: 1-methoxy-4-[4-[2-(4-pent-2-ynylphenyl)ethynyl]phenyl]benzene Formula: C26H22O MolecularWeight: 350.45228

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC#CCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H22O/c1-3-4-5-6-21-7-9-22(10-8-21)11-12-23-13-15-24(16-14-23)25-17-19-26(27-2)20-18-25/h7-10,13-20H,3,6H2,1-2H3