(4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1-pyrimidin-2-ylpiperidin-4-yl)methanone

Systemtic Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1-pyrimidin-2-ylpiperidin-4-yl)methanone Openeye Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1-pyrimidin-2-yl-4-piperidyl)methanone CAS Name: [4-(2-pyridin-1-iumyl)-1-piperazinyl]-[1-(2-pyrimidinyl)-4-piperidinyl]methanone IUPAC Name: (4-pyridin-1-ium-2-ylpiperazin-1-yl)-(1-pyrimidin-2-ylpiperidin-4-yl)methanone Traditional Name: (4-pyridin-1-ium-2-ylpiperazino)-[1-(2-pyrimidyl)-4-piperidyl]methanone Formula: C19H25N6O+ MolecularWeight: 353.4414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)C4=NC=CC=N4

InChI

InChI=1S/C19H24N6O/c26-18(16-5-10-25(11-6-16)19-21-8-3-9-22-19)24-14-12-23(13-15-24)17-4-1-2-7-20-17/h1-4,7-9,16H,5-6,10-15H2/p+1