3-(7-methoxy-1,3-benzodioxol-5-yl)propanoic acid

Systemtic Name: 3-(7-methoxy-1,3-benzodioxol-5-yl)propanoic acid Openeye Name: 3-(7-methoxy-1,3-benzodioxol-5-yl)propanoic acid CAS Name: 3-(7-methoxy-1,3-benzodioxol-5-yl)propanoic acid IUPAC Name: 3-(7-methoxy-1,3-benzodioxol-5-yl)propanoic acid Traditional Name: 3-(7-methoxy-1,3-benzodioxol-5-yl)propionic acid Formula: C11H12O5 MolecularWeight: 224.20998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)CCC(=O)O

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)CCC(=O)O

InChI

InChI=1S/C11H12O5/c1-14-8-4-7(2-3-10(12)13)5-9-11(8)16-6-15-9/h4-5H,2-3,6H2,1H3,(H,12,13)