methyl 2-[5-[[4-(4-cyanophenyl)phenoxy]methyl]-2-oxidanylidene-1-pyridin-2-yl-pyrrolidin-3-yl]ethanoate

Systemtic Name: methyl 2-[5-[[4-(4-cyanophenyl)phenoxy]methyl]-2-oxidanylidene-1-pyridin-2-yl-pyrrolidin-3-yl]ethanoate Openeye Name: methyl 2-[5-[[4-(4-cyanophenyl)phenoxy]methyl]-2-oxo-1-(2-pyridyl)pyrrolidin-3-yl]acetate CAS Name: 2-[5-[[4-(4-cyanophenyl)phenoxy]methyl]-2-oxo-1-(2-pyridinyl)-3-pyrrolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[[4-(4-cyanophenyl)phenoxy]methyl]-2-oxo-1-pyridin-2-ylpyrrolidin-3-yl]acetate Traditional Name: 2-[5-[[4-(4-cyanophenyl)phenoxy]methyl]-2-keto-1-(2-pyridyl)pyrrolidin-3-yl]acetic acid methyl ester Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC(N(C1=O)C2=CC=CC=N2)COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

COC(=O)CC1CC(N(C1=O)C2=CC=CC=N2)COC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H23N3O4/c1-32-25(30)15-21-14-22(29(26(21)31)24-4-2-3-13-28-24)17-33-23-11-9-20(10-12-23)19-7-5-18(16-27)6-8-19/h2-13,21-22H,14-15,17H2,1H3