[3-(acetyloxymethyl)-2-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxy-4-oxidanyl-phenyl)butyl] ethanoate

Systemtic Name: [3-(acetyloxymethyl)-2-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxy-4-oxidanyl-phenyl)butyl] ethanoate Openeye Name: [3-(acetoxymethyl)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-hydroxy-3-methoxy-phenyl)butyl] acetate CAS Name: acetic acid [3-(acetyloxymethyl)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-hydroxy-3-methoxyphenyl)butyl] ester IUPAC Name: [3-(acetyloxymethyl)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-hydroxy-3-methoxyphenyl)butyl] acetate Traditional Name: acetic acid [3-(acetoxymethyl)-4-(4-hydroxy-3-methoxy-phenyl)-2-piperonyl-butyl] ester Formula: C24H28O8 MolecularWeight: 444.47432

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(CC1=CC2=C(C=C1)OCO2)C(CC3=CC(=C(C=C3)O)OC)COC(=O)C

Isomeric SMILES

CC(=O)OCC(CC1=CC2=C(C=C1)OCO2)C(CC3=CC(=C(C=C3)O)OC)COC(=O)C

InChI

InChI=1S/C24H28O8/c1-15(25)29-12-19(8-17-4-6-21(27)23(10-17)28-3)20(13-30-16(2)26)9-18-5-7-22-24(11-18)32-14-31-22/h4-7,10-11,19-20,27H,8-9,12-14H2,1-3H3