1-methyl-4-[(E)-1,4,6-tris(4-methylphenyl)hex-3-en-1,5-diyn-3-yl]benzene

Systemtic Name: 1-methyl-4-[(E)-1,4,6-tris(4-methylphenyl)hex-3-en-1,5-diyn-3-yl]benzene Openeye Name: 1-[(E)-2,4-bis(p-tolyl)-1-[2-(p-tolyl)ethynyl]but-1-en-3-ynyl]-4-methyl-benzene CAS Name: 1-methyl-4-[(E)-1,4,6-tris(4-methylphenyl)hex-3-en-1,5-diyn-3-yl]benzene IUPAC Name: 1-methyl-4-[(E)-1,4,6-tris(4-methylphenyl)hex-3-en-1,5-diyn-3-yl]benzene Traditional Name: 1-[(E)-2,4-bis(p-tolyl)-1-[2-(p-tolyl)ethynyl]but-1-en-3-ynyl]-4-methyl-benzene Formula: C34H28 MolecularWeight: 436.58612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC(=C(C#CC2=CC=C(C=C2)C)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C#C/C(=C(/C#CC2=CC=C(C=C2)C)\C3=CC=C(C=C3)C)/C4=CC=C(C=C4)C

InChI

InChI=1S/C34H28/c1-25-5-13-29(14-6-25)17-23-33(31-19-9-27(3)10-20-31)34(32-21-11-28(4)12-22-32)24-18-30-15-7-26(2)8-16-30/h5-16,19-22H,1-4H3/b34-33+