6,7-dimethoxy-2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 6,7-dimethoxy-2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 6,7-dimethoxy-2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 6,7-dimethoxy-2-[2-(1-piperazin-4-iumyl)ethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 6,7-dimethoxy-2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 6,7-dimethoxy-2-(2-piperazin-4-ium-1-ylethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C17H29N3O2+2 MolecularWeight: 307.43106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCC2=C1)CCN3CC[NH2+]CC3)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCC2=C1)CCN3CC[NH2+]CC3)OC

InChI

InChI=1S/C17H27N3O2/c1-21-16-11-14-3-6-20(13-15(14)12-17(16)22-2)10-9-19-7-4-18-5-8-19/h11-12,18H,3-10,13H2,1-2H3/p+2