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

Systemtic Name: methyl (2R)-2-[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: methyl (2R)-2-[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-oxo-chromen-7-yl]oxypropanoate CAS Name: (2R)-2-[[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-oxo-1-benzopyran-7-yl]oxy]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-oxochromen-7-yl]oxypropanoate Traditional Name: (2R)-2-[3-(1,3-benzodioxol-5-yl)-6-ethyl-4-keto-chromen-7-yl]oxypropionic acid methyl ester Formula: C22H20O7 MolecularWeight: 396.39

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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)OC(C)C(=O)OC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCO4)O[C@H](C)C(=O)OC

InChI

InChI=1S/C22H20O7/c1-4-13-7-15-19(9-18(13)29-12(2)22(24)25-3)26-10-16(21(15)23)14-5-6-17-20(8-14)28-11-27-17/h5-10,12H,4,11H2,1-3H3/t12-/m1/s1