O2-[(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] O1-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O2-[(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] O1-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O2-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] O1-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O2-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] ester O1-tert-butyl ester IUPAC Name: 2-O-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] 1-O-tert-butyl (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O2-[(7-bromo-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl] ester O1-tert-butyl ester Formula: C19H23BrN3O5+ MolecularWeight: 453.30702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)OCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

InChI

InChI=1S/C19H22BrN3O5/c1-19(2,3)28-18(26)22-8-4-5-14(22)17(25)27-11-13-9-16(24)23-10-12(20)6-7-15(23)21-13/h6-7,9-10,14H,4-5,8,11H2,1-3H3/p+1/t14-/m0/s1