3-(2-oct-1-ynylphenyl)propanoic acid

Systemtic Name: 3-(2-oct-1-ynylphenyl)propanoic acid Openeye Name: 3-(2-oct-1-ynylphenyl)propanoic acid CAS Name: 3-(2-oct-1-ynylphenyl)propanoic acid IUPAC Name: 3-(2-oct-1-ynylphenyl)propanoic acid Traditional Name: 3-(2-oct-1-ynylphenyl)propionic acid Formula: C17H22O2 MolecularWeight: 258.35538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC=CC=C1CCC(=O)O

Isomeric SMILES

CCCCCCC#CC1=CC=CC=C1CCC(=O)O

InChI

InChI=1S/C17H22O2/c1-2-3-4-5-6-7-10-15-11-8-9-12-16(15)13-14-17(18)19/h8-9,11-12H,2-6,13-14H2,1H3,(H,18,19)