2,4-dimethoxy-3-(3-methylbutyl)-6-phenethyl-benzoic acid

Systemtic Name: 2,4-dimethoxy-3-(3-methylbutyl)-6-phenethyl-benzoic acid Openeye Name: 3-isopentyl-2,4-dimethoxy-6-phenethyl-benzoic acid CAS Name: 2,4-dimethoxy-3-(3-methylbutyl)-6-phenethylbenzoic acid IUPAC Name: 2,4-dimethoxy-3-(3-methylbutyl)-6-phenethylbenzoic acid Traditional Name: 3-isoamyl-2,4-dimethoxy-6-phenethyl-benzoic acid Formula: C22H28O4 MolecularWeight: 356.45532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(C=C(C(=C1OC)C(=O)O)CCC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)CCC1=C(C=C(C(=C1OC)C(=O)O)CCC2=CC=CC=C2)OC

InChI

InChI=1S/C22H28O4/c1-15(2)10-13-18-19(25-3)14-17(20(22(23)24)21(18)26-4)12-11-16-8-6-5-7-9-16/h5-9,14-15H,10-13H2,1-4H3,(H,23,24)