3-[3-(4-tert-butylphenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate

Systemtic Name: 3-[3-(4-tert-butylphenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: 3-[3-(4-tert-butylphenoxy)-4-oxo-chromen-7-yl]oxypropanoate CAS Name: 3-[[3-(4-tert-butylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]propanoate IUPAC Name: 3-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxypropanoate Traditional Name: 3-[3-(4-tert-butylphenoxy)-4-keto-chromen-7-yl]oxypropionate Formula: C22H21O6- MolecularWeight: 381.39854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O6/c1-22(2,3)14-4-6-15(7-5-14)28-19-13-27-18-12-16(26-11-10-20(23)24)8-9-17(18)21(19)25/h4-9,12-13H,10-11H2,1-3H3,(H,23,24)/p-1