5-(1,3-benzodioxol-5-yl)-2-methyl-furan-3-carboxylate

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-2-methyl-furan-3-carboxylate Openeye Name: 5-(1,3-benzodioxol-5-yl)-2-methyl-furan-3-carboxylate CAS Name: 5-(1,3-benzodioxol-5-yl)-2-methyl-3-furancarboxylate IUPAC Name: 5-(1,3-benzodioxol-5-yl)-2-methylfuran-3-carboxylate Traditional Name: 5-(1,3-benzodioxol-5-yl)-2-methyl-3-furoate Formula: C13H9O5- MolecularWeight: 245.20756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C2=CC3=C(C=C2)OCO3)C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(O1)C2=CC3=C(C=C2)OCO3)C(=O)[O-]

InChI

InChI=1S/C13H10O5/c1-7-9(13(14)15)5-11(18-7)8-2-3-10-12(4-8)17-6-16-10/h2-5H,6H2,1H3,(H,14,15)/p-1