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

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-2-ethyl-4-oxidanylidene-chromen-7-yl] propanoate Openeye Name: [3-(1,3-benzodioxol-5-yl)-2-ethyl-4-oxo-chromen-7-yl] propanoate CAS Name: propanoic acid [3-(1,3-benzodioxol-5-yl)-2-ethyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzodioxol-5-yl)-2-ethyl-4-oxochromen-7-yl] propanoate Traditional Name: propionic acid [3-(1,3-benzodioxol-5-yl)-2-ethyl-4-keto-chromen-7-yl] ester Formula: C21H18O6 MolecularWeight: 366.36402

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)CC)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)CC)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H18O6/c1-3-15-20(12-5-8-16-18(9-12)25-11-24-16)21(23)14-7-6-13(10-17(14)27-15)26-19(22)4-2/h5-10H,3-4,11H2,1-2H3