methyl 5-[3-(4-hydroxyphenyl)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]pentanoate

Systemtic Name: methyl 5-[3-(4-hydroxyphenyl)-7-oxidanyl-4-oxidanylidene-chromen-2-yl]pentanoate Openeye Name: methyl 5-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-chromen-2-yl]pentanoate CAS Name: 5-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-1-benzopyran-2-yl]pentanoic acid methyl ester IUPAC Name: methyl 5-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-2-yl]pentanoate Traditional Name: 5-[7-hydroxy-3-(4-hydroxyphenyl)-4-keto-chromen-2-yl]valeric acid methyl ester Formula: C21H20O6 MolecularWeight: 368.3799

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1=C(C(=O)C2=C(O1)C=C(C=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

COC(=O)CCCCC1=C(C(=O)C2=C(O1)C=C(C=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H20O6/c1-26-19(24)5-3-2-4-17-20(13-6-8-14(22)9-7-13)21(25)16-11-10-15(23)12-18(16)27-17/h6-12,22-23H,2-5H2,1H3