methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxidanyl-benzoate

Systemtic Name: methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-oxidanyl-benzoate Openeye Name: methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-hydroxy-benzoate CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-hydroxybenzoic acid methyl ester IUPAC Name: methyl 3-(1,3-benzodioxol-5-ylmethyl)-4-hydroxybenzoate Traditional Name: 4-hydroxy-3-piperonyl-benzoic acid methyl ester Formula: C16H14O5 MolecularWeight: 286.27936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)O)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)O)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H14O5/c1-19-16(18)11-3-4-13(17)12(8-11)6-10-2-5-14-15(7-10)21-9-20-14/h2-5,7-8,17H,6,9H2,1H3