azanyl-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-propyl-pyrimidin-4-ylcarbonyl-azanium

Systemtic Name: azanyl-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]-propyl-pyrimidin-4-ylcarbonyl-azanium Openeye Name: amino-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]-propyl-(pyrimidine-4-carbonyl)ammonium CAS Name: amino-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]-[oxo(4-pyrimidinyl)methyl]-propylammonium IUPAC Name: amino-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]-propyl-(pyrimidine-4-carbonyl)azanium Traditional Name: amino-[4-(5-chloro-2-methoxy-phenyl)piperazino]-propyl-(pyrimidine-4-carbonyl)ammonium Formula: C19H26ClN6O2+ MolecularWeight: 405.90174

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](C(=O)C1=NC=NC=C1)(N)N2CCN(CC2)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCC[N+](C(=O)C1=NC=NC=C1)(N)N2CCN(CC2)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C19H26ClN6O2/c1-3-12-26(21,19(27)16-6-7-22-14-23-16)25-10-8-24(9-11-25)17-13-15(20)4-5-18(17)28-2/h4-7,13-14H,3,8-12,21H2,1-2H3/q+1