[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate

Systemtic Name: [2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate Openeye Name: [2-(2,4-dimethoxyphenyl)-2-oxo-ethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate CAS Name: 2-(1-pyrrolidinyl)-3-pyridinecarboxylic acid [2-(2,4-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyphenyl)-2-oxoethyl] 2-pyrrolidin-1-ylpyridine-3-carboxylate Traditional Name: 2-pyrrolidinonicotinic acid [2-(2,4-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)COC(=O)C2=C(N=CC=C2)N3CCCC3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)COC(=O)C2=C(N=CC=C2)N3CCCC3)OC

InChI

InChI=1S/C20H22N2O5/c1-25-14-7-8-15(18(12-14)26-2)17(23)13-27-20(24)16-6-5-9-21-19(16)22-10-3-4-11-22/h5-9,12H,3-4,10-11,13H2,1-2H3