3-piperazin-4-ium-1-ylisoquinoline

Systemtic Name: 3-piperazin-4-ium-1-ylisoquinoline Openeye Name: 3-piperazin-4-ium-1-ylisoquinoline CAS Name: 3-(1-piperazin-4-iumyl)isoquinoline IUPAC Name: 3-piperazin-4-ium-1-ylisoquinoline Traditional Name: 3-piperazin-4-ium-1-ylisoquinoline Formula: C13H16N3+ MolecularWeight: 214.28624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC3=CC=CC=C3C=N2

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC3=CC=CC=C3C=N2

InChI

InChI=1S/C13H15N3/c1-2-4-12-10-15-13(9-11(12)3-1)16-7-5-14-6-8-16/h1-4,9-10,14H,5-8H2/p+1