6-methyl-1,3-benzodioxole-5-carboxylate

Systemtic Name: 6-methyl-1,3-benzodioxole-5-carboxylate Openeye Name: 6-methyl-1,3-benzodioxole-5-carboxylate CAS Name: 6-methyl-1,3-benzodioxole-5-carboxylate IUPAC Name: 6-methyl-1,3-benzodioxole-5-carboxylate Traditional Name: 6-methyl-piperonylate Formula: C9H7O4- MolecularWeight: 179.14948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)[O-])OCO2

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)[O-])OCO2

InChI

InChI=1S/C9H8O4/c1-5-2-7-8(13-4-12-7)3-6(5)9(10)11/h2-3H,4H2,1H3,(H,10,11)/p-1