3-[(3,5-dimethoxy-4-phenylmethoxy-phenyl)methyl]-4-methoxy-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[(3,5-dimethoxy-4-phenylmethoxy-phenyl)methyl]-4-methoxy-4-oxidanylidene-butanoic acid Openeye Name: 3-[(4-benzyloxy-3,5-dimethoxy-phenyl)methyl]-4-methoxy-4-oxo-butanoic acid CAS Name: 3-[(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]-4-methoxy-4-oxobutanoic acid IUPAC Name: 3-[(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]-4-methoxy-4-oxobutanoic acid Traditional Name: 3-(4-benzoxy-3,5-dimethoxy-benzyl)-4-keto-4-methoxy-butyric acid Formula: C21H24O7 MolecularWeight: 388.41106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)CC(CC(=O)O)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)CC(CC(=O)O)C(=O)OC

InChI

InChI=1S/C21H24O7/c1-25-17-10-15(9-16(12-19(22)23)21(24)27-3)11-18(26-2)20(17)28-13-14-7-5-4-6-8-14/h4-8,10-11,16H,9,12-13H2,1-3H3,(H,22,23)