2-[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-oxidanylidene-chromen-7-yl]oxyethanoic acid

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-oxidanylidene-chromen-7-yl]oxyethanoic acid Openeye Name: 2-[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-oxo-chromen-7-yl]oxyacetic acid CAS Name: 2-[[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-oxo-1-benzopyran-7-yl]oxy]acetic acid IUPAC Name: 2-[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-oxochromen-7-yl]oxyacetic acid Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-keto-chromen-7-yl]oxyacetic acid Formula: C20H16O7 MolecularWeight: 368.33684

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCO4)OCC(=O)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCO4)OCC(=O)O

InChI

InChI=1S/C20H16O7/c1-2-11-5-13-17(7-16(11)25-9-19(21)22)24-8-14(20(13)23)12-3-4-15-18(6-12)27-10-26-15/h3-8H,2,9-10H2,1H3,(H,21,22)