2-dec-1-ynyl-4-pentyl-1-(2-phenylethynyl)benzene

Systemtic Name: 2-dec-1-ynyl-4-pentyl-1-(2-phenylethynyl)benzene Openeye Name: 2-dec-1-ynyl-4-pentyl-1-(2-phenylethynyl)benzene CAS Name: 2-dec-1-ynyl-4-pentyl-1-(2-phenylethynyl)benzene IUPAC Name: 2-dec-1-ynyl-4-pentyl-1-(2-phenylethynyl)benzene Traditional Name: 4-amyl-2-dec-1-ynyl-1-(2-phenylethynyl)benzene Formula: C29H36 MolecularWeight: 384.59614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC#CC1=C(C=CC(=C1)CCCCC)C#CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC#CC1=C(C=CC(=C1)CCCCC)C#CC2=CC=CC=C2

InChI

InChI=1S/C29H36/c1-3-5-7-8-9-10-11-16-20-29-25-27(19-13-6-4-2)22-24-28(29)23-21-26-17-14-12-15-18-26/h12,14-15,17-18,22,24-25H,3-11,13,19H2,1-2H3