4-methyl-3-(5-oxidanylpent-1-ynyl)benzoic acid

Systemtic Name: 4-methyl-3-(5-oxidanylpent-1-ynyl)benzoic acid Openeye Name: 3-(5-hydroxypent-1-ynyl)-4-methyl-benzoic acid CAS Name: 3-(5-hydroxypent-1-ynyl)-4-methylbenzoic acid IUPAC Name: 3-(5-hydroxypent-1-ynyl)-4-methylbenzoic acid Traditional Name: 3-(5-hydroxypent-1-ynyl)-4-methyl-benzoic acid Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)C#CCCCO

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)C#CCCCO

InChI

InChI=1S/C13H14O3/c1-10-6-7-12(13(15)16)9-11(10)5-3-2-4-8-14/h6-7,9,14H,2,4,8H2,1H3,(H,15,16)