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

Systemtic Name: 7-(4-pentylphenyl)hept-5-ynoic acid Openeye Name: 7-(4-pentylphenyl)hept-5-ynoic acid CAS Name: 7-(4-pentylphenyl)-5-heptynoic acid IUPAC Name: 7-(4-pentylphenyl)hept-5-ynoic acid Traditional Name: 7-(4-amylphenyl)hept-5-ynoic acid Formula: C18H24O2 MolecularWeight: 272.38196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)CC#CCCCC(=O)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)CC#CCCCC(=O)O

InChI

InChI=1S/C18H24O2/c1-2-3-6-9-16-12-14-17(15-13-16)10-7-4-5-8-11-18(19)20/h12-15H,2-3,5-6,8-11H2,1H3,(H,19,20)