7-(4-heptylphenyl)hept-5-ynoic acid

Systemtic Name: 7-(4-heptylphenyl)hept-5-ynoic acid Openeye Name: 7-(4-heptylphenyl)hept-5-ynoic acid CAS Name: 7-(4-heptylphenyl)-5-heptynoic acid IUPAC Name: 7-(4-heptylphenyl)hept-5-ynoic acid Traditional Name: 7-(4-heptylphenyl)hept-5-ynoic acid Formula: C20H28O2 MolecularWeight: 300.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)CC#CCCCC(=O)O

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)CC#CCCCC(=O)O

InChI

InChI=1S/C20H28O2/c1-2-3-4-5-8-11-18-14-16-19(17-15-18)12-9-6-7-10-13-20(21)22/h14-17H,2-5,7-8,10-13H2,1H3,(H,21,22)