1-piperazin-4-ium-1-ylisoquinolin-2-ium-3-amine

Systemtic Name: 1-piperazin-4-ium-1-ylisoquinolin-2-ium-3-amine Openeye Name: 1-piperazin-4-ium-1-ylisoquinolin-2-ium-3-amine CAS Name: 1-(1-piperazin-4-iumyl)-3-isoquinolin-2-iumamine IUPAC Name: 1-piperazin-4-ium-1-ylisoquinolin-2-ium-3-amine Traditional Name: (1-piperazin-4-ium-1-ylisoquinolin-2-ium-3-yl)amine Formula: C13H18N4+2 MolecularWeight: 230.30882

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=[NH+]C(=CC3=CC=CC=C32)N

Isomeric SMILES

C1CN(CC[NH2+]1)C2=[NH+]C(=CC3=CC=CC=C32)N

InChI

InChI=1S/C13H16N4/c14-12-9-10-3-1-2-4-11(10)13(16-12)17-7-5-15-6-8-17/h1-4,9,15H,5-8H2,(H2,14,16)/p+2