2-[4-[(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]piperazin-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-[(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]piperazin-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]piperazin-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]-1-piperazinyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]piperazin-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-[(7-bromo-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]piperazino]-N-cyclopropyl-acetamide Formula: C18H23BrN5O2+ MolecularWeight: 421.31152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CN2CCN(CC2)CC3=CC(=O)[N+]4=C(N3)C=CC(=C4)Br

Isomeric SMILES

C1CC1NC(=O)CN2CCN(CC2)CC3=CC(=O)[N+]4=C(N3)C=CC(=C4)Br

InChI

InChI=1S/C18H22BrN5O2/c19-13-1-4-16-20-15(9-18(26)24(16)10-13)11-22-5-7-23(8-6-22)12-17(25)21-14-2-3-14/h1,4,9-10,14H,2-3,5-8,11-12H2,(H,21,25)/p+1