5-(4-methoxyphenyl)-2,2-dimethyl-pent-4-ynoic acid

Systemtic Name: 5-(4-methoxyphenyl)-2,2-dimethyl-pent-4-ynoic acid Openeye Name: 5-(4-methoxyphenyl)-2,2-dimethyl-pent-4-ynoic acid CAS Name: 5-(4-methoxyphenyl)-2,2-dimethyl-4-pentynoic acid IUPAC Name: 5-(4-methoxyphenyl)-2,2-dimethylpent-4-ynoic acid Traditional Name: 5-(4-methoxyphenyl)-2,2-dimethyl-pent-4-ynoic acid Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC#CC1=CC=C(C=C1)OC)C(=O)O

Isomeric SMILES

CC(C)(CC#CC1=CC=C(C=C1)OC)C(=O)O

InChI

InChI=1S/C14H16O3/c1-14(2,13(15)16)10-4-5-11-6-8-12(17-3)9-7-11/h6-9H,10H2,1-3H3,(H,15,16)