methyl 2-[3-(1-benzofuran-2-yl)-6-butyl-4-oxidanylidene-chromen-7-yl]oxypropanoate

Systemtic Name: methyl 2-[3-(1-benzofuran-2-yl)-6-butyl-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: methyl 2-[3-(benzofuran-2-yl)-6-butyl-4-oxo-chromen-7-yl]oxypropanoate CAS Name: 2-[[3-(2-benzofuranyl)-6-butyl-4-oxo-1-benzopyran-7-yl]oxy]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(1-benzofuran-2-yl)-6-butyl-4-oxochromen-7-yl]oxypropanoate Traditional Name: 2-[3-(benzofuran-2-yl)-6-butyl-4-keto-chromen-7-yl]oxypropionic acid methyl ester Formula: C25H24O6 MolecularWeight: 420.45446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=CC=CC=C4O3)OC(C)C(=O)OC

Isomeric SMILES

CCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=CC=CC=C4O3)OC(C)C(=O)OC

InChI

InChI=1S/C25H24O6/c1-4-5-8-16-11-18-22(13-21(16)30-15(2)25(27)28-3)29-14-19(24(18)26)23-12-17-9-6-7-10-20(17)31-23/h6-7,9-15H,4-5,8H2,1-3H3