3-[3-(3-methyl-4-propan-2-yl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate

Systemtic Name: 3-[3-(3-methyl-4-propan-2-yl-phenoxy)-4-oxidanylidene-chromen-7-yl]oxypropanoate Openeye Name: 3-[3-(4-isopropyl-3-methyl-phenoxy)-4-oxo-chromen-7-yl]oxypropanoate CAS Name: 3-[[3-(3-methyl-4-propan-2-ylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]propanoate IUPAC Name: 3-[3-(3-methyl-4-propan-2-ylphenoxy)-4-oxochromen-7-yl]oxypropanoate Traditional Name: 3-[3-(4-isopropyl-3-methyl-phenoxy)-4-keto-chromen-7-yl]oxypropionate Formula: C22H21O6- MolecularWeight: 381.39854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCCC(=O)[O-])C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCCC(=O)[O-])C(C)C

InChI

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