[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C16H13BrN2O3 MolecularWeight: 361.19002

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)OC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)OC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C16H13BrN2O3/c17-12-8-11(9-18-10-12)16(21)22-14-5-3-13(4-6-14)19-7-1-2-15(19)20/h3-6,8-10H,1-2,7H2