(2R)-2-[3-(4-ethoxyphenoxy)-4-oxidanylidene-chromen-7-yl]oxy-3-methyl-butanoate

Systemtic Name: (2R)-2-[3-(4-ethoxyphenoxy)-4-oxidanylidene-chromen-7-yl]oxy-3-methyl-butanoate Openeye Name: (2R)-2-[3-(4-ethoxyphenoxy)-4-oxo-chromen-7-yl]oxy-3-methyl-butanoate CAS Name: (2R)-2-[[3-(4-ethoxyphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]-3-methylbutanoate IUPAC Name: (2R)-2-[3-(4-ethoxyphenoxy)-4-oxochromen-7-yl]oxy-3-methylbutanoate Traditional Name: (2R)-2-[3-(4-ethoxyphenoxy)-4-keto-chromen-7-yl]oxy-3-methyl-butyrate Formula: C22H21O7- MolecularWeight: 397.39794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(C(C)C)C(=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)O[C@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C22H22O7/c1-4-26-14-5-7-15(8-6-14)28-19-12-27-18-11-16(9-10-17(18)20(19)23)29-21(13(2)3)22(24)25/h5-13,21H,4H2,1-3H3,(H,24,25)/p-1/t21-/m1/s1