2,2-dimethyl-3-[4-oxidanylidene-3-(4-propylphenoxy)chromen-7-yl]oxy-propanoate

Systemtic Name: 2,2-dimethyl-3-[4-oxidanylidene-3-(4-propylphenoxy)chromen-7-yl]oxy-propanoate Openeye Name: 2,2-dimethyl-3-[4-oxo-3-(4-propylphenoxy)chromen-7-yl]oxy-propanoate CAS Name: 2,2-dimethyl-3-[[4-oxo-3-(4-propylphenoxy)-1-benzopyran-7-yl]oxy]propanoate IUPAC Name: 2,2-dimethyl-3-[4-oxo-3-(4-propylphenoxy)chromen-7-yl]oxypropanoate Traditional Name: 3-[4-keto-3-(4-propylphenoxy)chromen-7-yl]oxy-2,2-dimethyl-propionate 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)OCC(C)(C)C(=O)[O-]

Isomeric SMILES

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

InChI

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