2-methyl-1-piperazin-1-yl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one

Systemtic Name: 2-methyl-1-piperazin-1-yl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one Openeye Name: 2-methyl-1-piperazin-1-yl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one CAS Name: 2-methyl-1-(1-piperazinyl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-propanone IUPAC Name: 2-methyl-1-piperazin-1-yl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one Traditional Name: 2-methyl-1-piperazino-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCNCC1)[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(C(=O)N1CCNCC1)[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H25N3O/c1-17(2,16(21)19-11-8-18-9-12-19)20-10-7-14-5-3-4-6-15(14)13-20/h3-6,18H,7-13H2,1-2H3/p+1