methyl 9-(3,4-dimethoxyphenyl)-6-oxidanyl-7-propanoyl-2,3-dihydrobenzo[g][1,4]benzodioxine-8-carboxylate

Systemtic Name: methyl 9-(3,4-dimethoxyphenyl)-6-oxidanyl-7-propanoyl-2,3-dihydrobenzo[g][1,4]benzodioxine-8-carboxylate Openeye Name: methyl 9-(3,4-dimethoxyphenyl)-6-hydroxy-7-propanoyl-2,3-dihydrobenzo[g][1,4]benzodioxine-8-carboxylate CAS Name: 9-(3,4-dimethoxyphenyl)-6-hydroxy-7-(1-oxopropyl)-2,3-dihydrobenzo[g][1,4]benzodioxin-8-carboxylic acid methyl ester IUPAC Name: methyl 9-(3,4-dimethoxyphenyl)-6-hydroxy-7-propanoyl-2,3-dihydrobenzo[g][1,4]benzodioxine-8-carboxylate Traditional Name: 9-(3,4-dimethoxyphenyl)-6-hydroxy-7-propionyl-2,3-dihydrobenzo[g][1,4]benzodioxin-8-carboxylic acid methyl ester Formula: C25H24O8 MolecularWeight: 452.45326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C2=CC3=C(C=C2C(=C1C(=O)OC)C4=CC(=C(C=C4)OC)OC)OCCO3)O

Isomeric SMILES

CCC(=O)C1=C(C2=CC3=C(C=C2C(=C1C(=O)OC)C4=CC(=C(C=C4)OC)OC)OCCO3)O

InChI

InChI=1S/C25H24O8/c1-5-16(26)22-23(25(28)31-4)21(13-6-7-17(29-2)18(10-13)30-3)14-11-19-20(33-9-8-32-19)12-15(14)24(22)27/h6-7,10-12,27H,5,8-9H2,1-4H3