2-[6-ethyl-3-(4-ethylphenoxy)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]ethanoic acid

Systemtic Name: 2-[6-ethyl-3-(4-ethylphenoxy)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]ethanoic acid Openeye Name: 2-[6-ethyl-3-(4-ethylphenoxy)-7-hydroxy-4-oxo-chromen-2-yl]acetic acid CAS Name: 2-[6-ethyl-3-(4-ethylphenoxy)-7-hydroxy-4-oxo-1-benzopyran-2-yl]acetic acid IUPAC Name: 2-[6-ethyl-3-(4-ethylphenoxy)-7-hydroxy-4-oxochromen-2-yl]acetic acid Traditional Name: 2-[6-ethyl-3-(4-ethylphenoxy)-7-hydroxy-4-keto-chromen-2-yl]acetic acid Formula: C21H20O6 MolecularWeight: 368.3799

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=C(OC3=CC(=C(C=C3C2=O)CC)O)CC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=C(OC3=CC(=C(C=C3C2=O)CC)O)CC(=O)O

InChI

InChI=1S/C21H20O6/c1-3-12-5-7-14(8-6-12)26-21-18(11-19(23)24)27-17-10-16(22)13(4-2)9-15(17)20(21)25/h5-10,22H,3-4,11H2,1-2H3,(H,23,24)