4-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde

Systemtic Name: 4-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Openeye Name: 2-(4-benzyl-1-piperidyl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde CAS Name: 4-oxo-2-[4-(phenylmethyl)-1-piperidinyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxaldehyde IUPAC Name: 2-(4-benzylpiperidin-1-yl)-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Traditional Name: 2-(4-benzylpiperidino)-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Formula: C21H22N3O2+ MolecularWeight: 348.41828

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=O)[N+]4=CC=CC=C4N3)C=O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=O)[N+]4=CC=CC=C4N3)C=O

InChI

InChI=1S/C21H21N3O2/c25-15-18-20(22-19-8-4-5-11-24(19)21(18)26)23-12-9-17(10-13-23)14-16-6-2-1-3-7-16/h1-8,11,15,17H,9-10,12-14H2/p+1