5-(2,3,6-trimethylphenoxy)pentanoic acid

Systemtic Name: 5-(2,3,6-trimethylphenoxy)pentanoic acid Openeye Name: 5-(2,3,6-trimethylphenoxy)pentanoic acid CAS Name: 5-(2,3,6-trimethylphenoxy)pentanoic acid IUPAC Name: 5-(2,3,6-trimethylphenoxy)pentanoic acid Traditional Name: 5-(2,3,6-trimethylphenoxy)valeric acid Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCCCC(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCCCC(=O)O)C

InChI

InChI=1S/C14H20O3/c1-10-7-8-11(2)14(12(10)3)17-9-5-4-6-13(15)16/h7-8H,4-6,9H2,1-3H3,(H,15,16)