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

Systemtic Name: methyl 2-[5-[[2-bromanyl-4-(4-cyanophenyl)phenoxy]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoate Openeye Name: methyl 2-[5-[[2-bromo-4-(4-cyanophenyl)phenoxy]methyl]-2-oxo-pyrrolidin-3-yl]acetate CAS Name: 2-[5-[[2-bromo-4-(4-cyanophenyl)phenoxy]methyl]-2-oxo-3-pyrrolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[[2-bromo-4-(4-cyanophenyl)phenoxy]methyl]-2-oxopyrrolidin-3-yl]acetate Traditional Name: 2-[5-[[2-bromo-4-(4-cyanophenyl)phenoxy]methyl]-2-keto-pyrrolidin-3-yl]acetic acid methyl ester Formula: C21H19BrN2O4 MolecularWeight: 443.29056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC(NC1=O)COC2=C(C=C(C=C2)C3=CC=C(C=C3)C#N)Br

Isomeric SMILES

COC(=O)CC1CC(NC1=O)COC2=C(C=C(C=C2)C3=CC=C(C=C3)C#N)Br

InChI

InChI=1S/C21H19BrN2O4/c1-27-20(25)10-16-8-17(24-21(16)26)12-28-19-7-6-15(9-18(19)22)14-4-2-13(11-23)3-5-14/h2-7,9,16-17H,8,10,12H2,1H3,(H,24,26)