2-[1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-4-oxidanylidene-cyclohexyl]propanoic acid

Systemtic Name: 2-[1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-4-oxidanylidene-cyclohexyl]propanoic acid Openeye Name: 2-[1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-4-oxo-cyclohexyl]propanoic acid CAS Name: 2-[1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-4-oxocyclohexyl]propanoic acid IUPAC Name: 2-[1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)-4-oxocyclohexyl]propanoic acid Traditional Name: 2-[4-keto-1-(5-methoxy-2,3-dihydro-1,4-benzodioxin-8-yl)cyclohexyl]propionic acid Formula: C18H22O6 MolecularWeight: 334.36368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)C1(CCC(=O)CC1)C2=C3C(=C(C=C2)OC)OCCO3

Isomeric SMILES

CC(C(=O)O)C1(CCC(=O)CC1)C2=C3C(=C(C=C2)OC)OCCO3

InChI

InChI=1S/C18H22O6/c1-11(17(20)21)18(7-5-12(19)6-8-18)13-3-4-14(22-2)16-15(13)23-9-10-24-16/h3-4,11H,5-10H2,1-2H3,(H,20,21)