[2-(2-oxidanylidenepyridin-1-yl)-1-pyrrolidin-1-yl-ethenyl] 4-bromanylbenzoate

Systemtic Name: [2-(2-oxidanylidenepyridin-1-yl)-1-pyrrolidin-1-yl-ethenyl] 4-bromanylbenzoate Openeye Name: [2-(2-oxo-1-pyridyl)-1-pyrrolidin-1-yl-vinyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(2-oxo-1-pyridinyl)-1-(1-pyrrolidinyl)ethenyl] ester IUPAC Name: [2-(2-oxopyridin-1-yl)-1-pyrrolidin-1-ylethenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(2-keto-1-pyridyl)-1-pyrrolidino-vinyl] ester Formula: C18H17BrN2O3 MolecularWeight: 389.24318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=CN2C=CC=CC2=O)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CCN(C1)C(=CN2C=CC=CC2=O)OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O3/c19-15-8-6-14(7-9-15)18(23)24-17(20-10-3-4-11-20)13-21-12-2-1-5-16(21)22/h1-2,5-9,12-13H,3-4,10-11H2