2-(azocan-1-ylmethyl)-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-(azocan-1-ylmethyl)-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-(azocan-1-ylmethyl)-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-(1-azocanylmethyl)-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-(azocan-1-ylmethyl)-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-(azocan-1-ylmethyl)-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CN3CCCCCCC3

Isomeric SMILES

CC1=C2NC(=CC(=O)[N+]2=CC=C1)CN3CCCCCCC3

InChI

InChI=1S/C17H23N3O/c1-14-8-7-11-20-16(21)12-15(18-17(14)20)13-19-9-5-3-2-4-6-10-19/h7-8,11-12H,2-6,9-10,13H2,1H3/p+1