2-(1,4-diazepan-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-(1,4-diazepan-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-(1,4-diazepan-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one CAS Name: 2-(1,4-diazepan-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-(1,4-diazepan-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-(1,4-diazepan-4-ium-1-yl)-6-methyl-1H-pyrimidin-4-one Formula: C10H17N4O+ MolecularWeight: 209.26818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)N2CCC[NH2+]CC2

Isomeric SMILES

CC1=CC(=O)N=C(N1)N2CCC[NH2+]CC2

InChI

InChI=1S/C10H16N4O/c1-8-7-9(15)13-10(12-8)14-5-2-3-11-4-6-14/h7,11H,2-6H2,1H3,(H,12,13,15)/p+1