2-[3-butyl-4-methoxy-5-(3-methylcyclohexyl)phenyl]ethanoic acid

Systemtic Name: 2-[3-butyl-4-methoxy-5-(3-methylcyclohexyl)phenyl]ethanoic acid Openeye Name: 2-[3-butyl-4-methoxy-5-(3-methylcyclohexyl)phenyl]acetic acid CAS Name: 2-[3-butyl-4-methoxy-5-(3-methylcyclohexyl)phenyl]acetic acid IUPAC Name: 2-[3-butyl-4-methoxy-5-(3-methylcyclohexyl)phenyl]acetic acid Traditional Name: 2-[3-butyl-4-methoxy-5-(3-methylcyclohexyl)phenyl]acetic acid Formula: C20H30O3 MolecularWeight: 318.4504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CC(=C1)CC(=O)O)C2CCCC(C2)C)OC

Isomeric SMILES

CCCCC1=C(C(=CC(=C1)CC(=O)O)C2CCCC(C2)C)OC

InChI

InChI=1S/C20H30O3/c1-4-5-8-17-11-15(13-19(21)22)12-18(20(17)23-3)16-9-6-7-14(2)10-16/h11-12,14,16H,4-10,13H2,1-3H3,(H,21,22)