3-(4-ethyl-2,6-dimethyl-1,3-benzodioxol-5-yl)propanoic acid

Systemtic Name: 3-(4-ethyl-2,6-dimethyl-1,3-benzodioxol-5-yl)propanoic acid Openeye Name: 3-(4-ethyl-2,6-dimethyl-1,3-benzodioxol-5-yl)propanoic acid CAS Name: 3-(4-ethyl-2,6-dimethyl-1,3-benzodioxol-5-yl)propanoic acid IUPAC Name: 3-(4-ethyl-2,6-dimethyl-1,3-benzodioxol-5-yl)propanoic acid Traditional Name: 3-(4-ethyl-2,6-dimethyl-1,3-benzodioxol-5-yl)propionic acid Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC2=C1OC(O2)C)C)CCC(=O)O

Isomeric SMILES

CCC1=C(C(=CC2=C1OC(O2)C)C)CCC(=O)O

InChI

InChI=1S/C14H18O4/c1-4-10-11(5-6-13(15)16)8(2)7-12-14(10)18-9(3)17-12/h7,9H,4-6H2,1-3H3,(H,15,16)