2-[4-(3-chlorophenyl)piperazin-1-yl]pyridin-1-ium-3-amine

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]pyridin-1-ium-3-amine Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]pyridin-1-ium-3-amine CAS Name: 2-[4-(3-chlorophenyl)-1-piperazinyl]-3-pyridin-1-iumamine IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]pyridin-1-ium-3-amine Traditional Name: [2-[4-(3-chlorophenyl)piperazino]pyridin-1-ium-3-yl]amine Formula: C15H18ClN4+ MolecularWeight: 289.78322

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C=CC=[NH+]3)N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C=CC=[NH+]3)N

InChI

InChI=1S/C15H17ClN4/c16-12-3-1-4-13(11-12)19-7-9-20(10-8-19)15-14(17)5-2-6-18-15/h1-6,11H,7-10,17H2/p+1