3-(2-methoxy-4-propan-2-yloxy-phenyl)octanoic acid

Systemtic Name: 3-(2-methoxy-4-propan-2-yloxy-phenyl)octanoic acid Openeye Name: 3-(4-isopropoxy-2-methoxy-phenyl)octanoic acid CAS Name: 3-(2-methoxy-4-propan-2-yloxyphenyl)octanoic acid IUPAC Name: 3-(2-methoxy-4-propan-2-yloxyphenyl)octanoic acid Traditional Name: 3-(4-isopropoxy-2-methoxy-phenyl)caprylic acid Formula: C18H28O4 MolecularWeight: 308.41252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28O4/c1-5-6-7-8-14(11-18(19)20)16-10-9-15(22-13(2)3)12-17(16)21-4/h9-10,12-14H,5-8,11H2,1-4H3,(H,19,20)