3-[4-[(2-acetyloxy-3,4-dimethoxy-6-methyl-phenyl)methyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[(2-acetyloxy-3,4-dimethoxy-6-methyl-phenyl)methyl]phenyl]propanoic acid Openeye Name: 3-[4-[(2-acetoxy-3,4-dimethoxy-6-methyl-phenyl)methyl]phenyl]propanoic acid CAS Name: 3-[4-[(2-acetyloxy-3,4-dimethoxy-6-methylphenyl)methyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(2-acetyloxy-3,4-dimethoxy-6-methylphenyl)methyl]phenyl]propanoic acid Traditional Name: 3-[4-(2-acetoxy-3,4-dimethoxy-6-methyl-benzyl)phenyl]propionic acid Formula: C21H24O6 MolecularWeight: 372.41166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CC2=CC=C(C=C2)CCC(=O)O)OC(=O)C)OC)OC

Isomeric SMILES

CC1=CC(=C(C(=C1CC2=CC=C(C=C2)CCC(=O)O)OC(=O)C)OC)OC

InChI

InChI=1S/C21H24O6/c1-13-11-18(25-3)21(26-4)20(27-14(2)22)17(13)12-16-7-5-15(6-8-16)9-10-19(23)24/h5-8,11H,9-10,12H2,1-4H3,(H,23,24)