4-methoxy-3-(2-methyloctan-2-yl)benzoic acid

Systemtic Name: 4-methoxy-3-(2-methyloctan-2-yl)benzoic acid Openeye Name: 3-(1,1-dimethylheptyl)-4-methoxy-benzoic acid CAS Name: 4-methoxy-3-(2-methyloctan-2-yl)benzoic acid IUPAC Name: 4-methoxy-3-(2-methyloctan-2-yl)benzoic acid Traditional Name: 3-(1,1-dimethylheptyl)-4-methoxy-benzoic acid Formula: C17H26O3 MolecularWeight: 278.38654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=C(C=CC(=C1)C(=O)O)OC

Isomeric SMILES

CCCCCCC(C)(C)C1=C(C=CC(=C1)C(=O)O)OC

InChI

InChI=1S/C17H26O3/c1-5-6-7-8-11-17(2,3)14-12-13(16(18)19)9-10-15(14)20-4/h9-10,12H,5-8,11H2,1-4H3,(H,18,19)