dimethyl 2-[(2-oxidanyl-4-oxidanylidene-chromen-3-yl)-phenyl-methyl]propanedioate

Systemtic Name: dimethyl 2-[(2-oxidanyl-4-oxidanylidene-chromen-3-yl)-phenyl-methyl]propanedioate Openeye Name: dimethyl 2-[(2-hydroxy-4-oxo-chromen-3-yl)-phenyl-methyl]propanedioate CAS Name: 2-[(2-hydroxy-4-oxo-1-benzopyran-3-yl)-phenylmethyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-hydroxy-4-oxochromen-3-yl)-phenylmethyl]propanedioate Traditional Name: 2-[(2-hydroxy-4-keto-chromen-3-yl)-phenyl-methyl]malonic acid dimethyl ester Formula: C21H18O7 MolecularWeight: 382.36342

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)O)C(=O)OC

Isomeric SMILES

COC(=O)C(C(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)O)C(=O)OC

InChI

InChI=1S/C21H18O7/c1-26-19(23)17(20(24)27-2)15(12-8-4-3-5-9-12)16-18(22)13-10-6-7-11-14(13)28-21(16)25/h3-11,15,17,25H,1-2H3