dimethyl 2-[2-[(4-methoxyphenyl)methyl]-3-oxidanylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]propanedioate

Systemtic Name: dimethyl 2-[2-[(4-methoxyphenyl)methyl]-3-oxidanylidene-1H-pyrrolo[2,3-b]pyridin-2-yl]propanedioate Openeye Name: dimethyl 2-[2-[(4-methoxyphenyl)methyl]-3-oxo-1H-pyrrolo[2,3-b]pyridin-2-yl]propanedioate CAS Name: 2-[2-[(4-methoxyphenyl)methyl]-3-oxo-1H-pyrrolo[2,3-b]pyridin-2-yl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[2-[(4-methoxyphenyl)methyl]-3-oxo-1H-pyrrolo[2,3-b]pyridin-2-yl]propanedioate Traditional Name: 2-(3-keto-2-p-anisyl-1H-pyrrolo[2,3-b]pyridin-2-yl)malonic acid dimethyl ester Formula: C20H20N2O6 MolecularWeight: 384.3826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2(C(=O)C3=C(N2)N=CC=C3)C(C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CC2(C(=O)C3=C(N2)N=CC=C3)C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H20N2O6/c1-26-13-8-6-12(7-9-13)11-20(15(18(24)27-2)19(25)28-3)16(23)14-5-4-10-21-17(14)22-20/h4-10,15H,11H2,1-3H3,(H,21,22)