2-(3-piperazin-4-ium-1-ylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-(3-piperazin-4-ium-1-ylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-(3-piperazin-4-ium-1-ylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[3-(1-piperazin-4-iumyl)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-(3-piperazin-4-ium-1-ylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-(3-piperazin-4-ium-1-ylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C16H27N3+2 MolecularWeight: 261.40568

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CCCN3CC[NH2+]CC3

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CCCN3CC[NH2+]CC3

InChI

InChI=1S/C16H25N3/c1-2-5-16-14-19(11-6-15(16)4-1)10-3-9-18-12-7-17-8-13-18/h1-2,4-5,17H,3,6-14H2/p+2