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

Systemtic Name: 2-[(7-bromanyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-ethyl-amino]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-ethyl-amino]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-ethylamino]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[(7-bromo-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-ethylamino]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[(7-bromo-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-ethyl-amino]-N-(4-methoxyphenyl)acetamide Formula: C20H22BrN4O3+ MolecularWeight: 446.31768

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=O)[N+]2=C(N1)C=CC(=C2)Br)CC(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC1=CC(=O)[N+]2=C(N1)C=CC(=C2)Br)CC(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21BrN4O3/c1-3-24(13-19(26)23-15-5-7-17(28-2)8-6-15)12-16-10-20(27)25-11-14(21)4-9-18(25)22-16/h4-11H,3,12-13H2,1-2H3,(H,23,26)/p+1