[4-(azepan-1-yl)pyrimidin-2-yl]-ethyl-hexyl-methyl-azanium

Systemtic Name: [4-(azepan-1-yl)pyrimidin-2-yl]-ethyl-hexyl-methyl-azanium Openeye Name: [4-(azepan-1-yl)pyrimidin-2-yl]-ethyl-hexyl-methyl-ammonium CAS Name: [4-(1-azepanyl)-2-pyrimidinyl]-ethyl-hexyl-methylammonium IUPAC Name: [4-(azepan-1-yl)pyrimidin-2-yl]-ethyl-hexyl-methylazanium Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-ethyl-hexyl-methyl-ammonium Formula: C19H35N4+ MolecularWeight: 319.508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+](C)(CC)C1=NC=CC(=N1)N2CCCCCC2

Isomeric SMILES

CCCCCC[N+](C)(CC)C1=NC=CC(=N1)N2CCCCCC2

InChI

InChI=1S/C19H35N4/c1-4-6-7-12-17-23(3,5-2)19-20-14-13-18(21-19)22-15-10-8-9-11-16-22/h13-14H,4-12,15-17H2,1-3H3/q+1