(4-aminocarbonylphenyl)methyl-cyclopropyl-[(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]azanium

Systemtic Name: (4-aminocarbonylphenyl)methyl-cyclopropyl-[(7-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]azanium Openeye Name: (4-carbamoylphenyl)methyl-cyclopropyl-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]ammonium CAS Name: (4-carbamoylphenyl)methyl-cyclopropyl-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]ammonium IUPAC Name: (4-carbamoylphenyl)methyl-cyclopropyl-[(7-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]azanium Traditional Name: (4-carbamoylbenzyl)-cyclopropyl-[(4-keto-7-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]ammonium Formula: C21H24N4O2+2 MolecularWeight: 364.44086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(C=C1)NC(=CC2=O)C[NH+](CC3=CC=C(C=C3)C(=O)N)C4CC4

Isomeric SMILES

CC1=C[N+]2=C(C=C1)NC(=CC2=O)C[NH+](CC3=CC=C(C=C3)C(=O)N)C4CC4

InChI

InChI=1S/C21H22N4O2/c1-14-2-9-19-23-17(10-20(26)25(19)11-14)13-24(18-7-8-18)12-15-3-5-16(6-4-15)21(22)27/h2-6,9-11,18H,7-8,12-13H2,1H3,(H2,22,27)/p+2