7-chloranyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-1-ium

Systemtic Name: 7-chloranyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-1-ium Openeye Name: 7-chloro-4-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-1-ium CAS Name: 7-chloro-4-[4-(2-pyrimidinyl)-1-piperazinyl]quinolin-1-ium IUPAC Name: 7-chloro-4-(4-pyrimidin-2-ylpiperazin-1-yl)quinolin-1-ium Traditional Name: 7-chloro-4-[4-(2-pyrimidyl)piperazino]quinolin-1-ium Formula: C17H17ClN5+ MolecularWeight: 326.80338

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=CC(=CC3=[NH+]C=C2)Cl)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1C2=C3C=CC(=CC3=[NH+]C=C2)Cl)C4=NC=CC=N4

InChI

InChI=1S/C17H16ClN5/c18-13-2-3-14-15(12-13)19-7-4-16(14)22-8-10-23(11-9-22)17-20-5-1-6-21-17/h1-7,12H,8-11H2/p+1