4-heptyl-1-(2-phenylethynyl)-2-prop-1-ynyl-benzene

Systemtic Name: 4-heptyl-1-(2-phenylethynyl)-2-prop-1-ynyl-benzene Openeye Name: 4-heptyl-1-(2-phenylethynyl)-2-prop-1-ynyl-benzene CAS Name: 4-heptyl-1-(2-phenylethynyl)-2-prop-1-ynylbenzene IUPAC Name: 4-heptyl-1-(2-phenylethynyl)-2-prop-1-ynylbenzene Traditional Name: 4-heptyl-1-(2-phenylethynyl)-2-prop-1-ynyl-benzene Formula: C24H26 MolecularWeight: 314.46324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=C(C=C1)C#CC2=CC=CC=C2)C#CC

Isomeric SMILES

CCCCCCCC1=CC(=C(C=C1)C#CC2=CC=CC=C2)C#CC

InChI

InChI=1S/C24H26/c1-3-5-6-7-9-15-22-17-19-23(24(20-22)12-4-2)18-16-21-13-10-8-11-14-21/h8,10-11,13-14,17,19-20H,3,5-7,9,15H2,1-2H3