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

Systemtic Name: (2R)-3-methyl-2-[4-oxidanylidene-3-(4-propylphenoxy)chromen-7-yl]oxy-butanoate Openeye Name: (2R)-3-methyl-2-[4-oxo-3-(4-propylphenoxy)chromen-7-yl]oxy-butanoate CAS Name: (2R)-3-methyl-2-[[4-oxo-3-(4-propylphenoxy)-1-benzopyran-7-yl]oxy]butanoate IUPAC Name: (2R)-3-methyl-2-[4-oxo-3-(4-propylphenoxy)chromen-7-yl]oxybutanoate Traditional Name: (2R)-2-[4-keto-3-(4-propylphenoxy)chromen-7-yl]oxy-3-methyl-butyrate Formula: C23H23O6- MolecularWeight: 395.42512

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OC(C(C)C)C(=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)O[C@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C23H24O6/c1-4-5-15-6-8-16(9-7-15)28-20-13-27-19-12-17(10-11-18(19)21(20)24)29-22(14(2)3)23(25)26/h6-14,22H,4-5H2,1-3H3,(H,25,26)/p-1/t22-/m1/s1