3-methylbutyl 2-[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate

Systemtic Name: 3-methylbutyl 2-[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: isopentyl 2-[3-(3-methylphenoxy)-4-oxo-chromen-7-yl]oxypropanoate CAS Name: 2-[[3-(3-methylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]propanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[3-(3-methylphenoxy)-4-oxochromen-7-yl]oxypropanoate Traditional Name: 2-[4-keto-3-(3-methylphenoxy)chromen-7-yl]oxypropionic acid isoamyl ester Formula: C24H26O6 MolecularWeight: 410.45964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(C)C(=O)OCCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(C)C(=O)OCCC(C)C

InChI

InChI=1S/C24H26O6/c1-15(2)10-11-27-24(26)17(4)29-19-8-9-20-21(13-19)28-14-22(23(20)25)30-18-7-5-6-16(3)12-18/h5-9,12-15,17H,10-11H2,1-4H3