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

Systemtic Name: [3-(1,3-benzodioxol-5-yl)-6-ethyl-2-methyl-4-oxidanylidene-chromen-7-yl] ethanoate Openeye Name: [3-(1,3-benzodioxol-5-yl)-6-ethyl-2-methyl-4-oxo-chromen-7-yl] acetate CAS Name: acetic acid [3-(1,3-benzodioxol-5-yl)-6-ethyl-2-methyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzodioxol-5-yl)-6-ethyl-2-methyl-4-oxochromen-7-yl] acetate Traditional Name: acetic acid [3-(1,3-benzodioxol-5-yl)-6-ethyl-4-keto-2-methyl-chromen-7-yl] ester Formula: C21H18O6 MolecularWeight: 366.36402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCO4)OC(=O)C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCO4)OC(=O)C

InChI

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