1-methyl-4-(4-oct-1-ynylphenyl)benzene

Systemtic Name: 1-methyl-4-(4-oct-1-ynylphenyl)benzene Openeye Name: 1-methyl-4-(4-oct-1-ynylphenyl)benzene CAS Name: 1-methyl-4-(4-oct-1-ynylphenyl)benzene IUPAC Name: 1-methyl-4-(4-oct-1-ynylphenyl)benzene Traditional Name: 1-methyl-4-(4-oct-1-ynylphenyl)benzene Formula: C21H24 MolecularWeight: 276.41526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC=C(C=C1)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCC#CC1=CC=C(C=C1)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H24/c1-3-4-5-6-7-8-9-19-12-16-21(17-13-19)20-14-10-18(2)11-15-20/h10-17H,3-7H2,1-2H3