[3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxidanylidene-chromen-6-yl] 2-methylpropanoate

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxidanylidene-chromen-6-yl] 2-methylpropanoate Openeye Name: [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-chromen-6-yl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-1-benzopyran-6-yl] ester IUPAC Name: [3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxochromen-6-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [3-(1,3-benzodioxol-5-yl)-2-keto-4-methyl-chromen-6-yl] ester Formula: C21H18O6 MolecularWeight: 366.36402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C(C=C2)OC(=O)C(C)C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C(C=C2)OC(=O)C(C)C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H18O6/c1-11(2)20(22)26-14-5-7-16-15(9-14)12(3)19(21(23)27-16)13-4-6-17-18(8-13)25-10-24-17/h4-9,11H,10H2,1-3H3