3-oxidanylpropyl 9-(1,3-benzodioxol-5-yl)-8-methyl-benzo[g][1,3]benzodioxole-7-carboxylate

Systemtic Name: 3-oxidanylpropyl 9-(1,3-benzodioxol-5-yl)-8-methyl-benzo[g][1,3]benzodioxole-7-carboxylate Openeye Name: 3-hydroxypropyl 9-(1,3-benzodioxol-5-yl)-8-methyl-benzo[g][1,3]benzodioxole-7-carboxylate CAS Name: 9-(1,3-benzodioxol-5-yl)-8-methyl-7-benzo[g][1,3]benzodioxolecarboxylic acid 3-hydroxypropyl ester IUPAC Name: 3-hydroxypropyl 9-(1,3-benzodioxol-5-yl)-8-methylbenzo[g][1,3]benzodioxole-7-carboxylate Traditional Name: 9-(1,3-benzodioxol-5-yl)-8-methyl-benzo[g][1,3]benzodioxole-7-carboxylic acid 3-hydroxypropyl ester Formula: C23H20O7 MolecularWeight: 408.4007

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC3=C(C2=C1C4=CC5=C(C=C4)OCO5)OCO3)C(=O)OCCCO

Isomeric SMILES

CC1=C(C=C2C=CC3=C(C2=C1C4=CC5=C(C=C4)OCO5)OCO3)C(=O)OCCCO

InChI

InChI=1S/C23H20O7/c1-13-16(23(25)26-8-2-7-24)9-14-4-6-18-22(30-12-28-18)21(14)20(13)15-3-5-17-19(10-15)29-11-27-17/h3-6,9-10,24H,2,7-8,11-12H2,1H3