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

Systemtic Name: cyclopropyl-[(4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: cyclopropyl-[(4-isopropylphenyl)methyl]-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]ammonium CAS Name: cyclopropyl-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: cyclopropyl-[(4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: cyclopropyl-(4-isopropylbenzyl)-[(4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]ammonium Formula: C22H27N3O+2 MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+](CC2=CC(=O)[N+]3=CC=CC=C3N2)C4CC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+](CC2=CC(=O)[N+]3=CC=CC=C3N2)C4CC4

InChI

InChI=1S/C22H25N3O/c1-16(2)18-8-6-17(7-9-18)14-24(20-10-11-20)15-19-13-22(26)25-12-4-3-5-21(25)23-19/h3-9,12-13,16,20H,10-11,14-15H2,1-2H3/p+2