methyl 4-[5-(hydroxymethyl)-7-propoxy-1,3-benzodioxol-4-yl]-7-propoxy-1,3-benzodioxole-5-carboxylate

Systemtic Name: methyl 4-[5-(hydroxymethyl)-7-propoxy-1,3-benzodioxol-4-yl]-7-propoxy-1,3-benzodioxole-5-carboxylate Openeye Name: methyl 4-[5-(hydroxymethyl)-7-propoxy-1,3-benzodioxol-4-yl]-7-propoxy-1,3-benzodioxole-5-carboxylate CAS Name: 4-[5-(hydroxymethyl)-7-propoxy-1,3-benzodioxol-4-yl]-7-propoxy-1,3-benzodioxole-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[5-(hydroxymethyl)-7-propoxy-1,3-benzodioxol-4-yl]-7-propoxy-1,3-benzodioxole-5-carboxylate Traditional Name: 4-(5-methylol-7-propoxy-1,3-benzodioxol-4-yl)-7-propoxy-piperonylic acid methyl ester Formula: C23H26O9 MolecularWeight: 446.44714

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C2C(=C(C(=C1)CO)C3=C4C(=C(C=C3C(=O)OC)OCCC)OCO4)OCO2

Isomeric SMILES

CCCOC1=C2C(=C(C(=C1)CO)C3=C4C(=C(C=C3C(=O)OC)OCCC)OCO4)OCO2

InChI

InChI=1S/C23H26O9/c1-4-6-27-15-8-13(10-24)17(21-19(15)29-11-31-21)18-14(23(25)26-3)9-16(28-7-5-2)20-22(18)32-12-30-20/h8-9,24H,4-7,10-12H2,1-3H3