dimethyl 2,3-bis[(3-methoxy-4-oxidanyl-phenyl)methyl]butanedioate

Systemtic Name: dimethyl 2,3-bis[(3-methoxy-4-oxidanyl-phenyl)methyl]butanedioate Openeye Name: dimethyl 2,3-bis[(4-hydroxy-3-methoxy-phenyl)methyl]butanedioate CAS Name: 2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]butanedioic acid dimethyl ester IUPAC Name: dimethyl 2,3-bis[(4-hydroxy-3-methoxyphenyl)methyl]butanedioate Traditional Name: 2,3-divanillylsuccinic acid dimethyl ester Formula: C22H26O8 MolecularWeight: 418.43704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(C(CC2=CC(=C(C=C2)O)OC)C(=O)OC)C(=O)OC)O

Isomeric SMILES

COC1=C(C=CC(=C1)CC(C(CC2=CC(=C(C=C2)O)OC)C(=O)OC)C(=O)OC)O

InChI

InChI=1S/C22H26O8/c1-27-19-11-13(5-7-17(19)23)9-15(21(25)29-3)16(22(26)30-4)10-14-6-8-18(24)20(12-14)28-2/h5-8,11-12,15-16,23-24H,9-10H2,1-4H3