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

Systemtic Name: 2,2-dimethyl-1-piperazin-1-yl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one Openeye Name: 2,2-dimethyl-1-piperazin-1-yl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one CAS Name: 2,2-dimethyl-1-(1-piperazinyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-propanone IUPAC Name: 2,2-dimethyl-1-piperazin-1-yl-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one Traditional Name: 2,2-dimethyl-1-piperazino-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propan-1-one Formula: C18H28N3O+ MolecularWeight: 302.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH+]1CCC2=CC=CC=C2C1)C(=O)N3CCNCC3

Isomeric SMILES

CC(C)(C[NH+]1CCC2=CC=CC=C2C1)C(=O)N3CCNCC3

InChI

InChI=1S/C18H27N3O/c1-18(2,17(22)21-11-8-19-9-12-21)14-20-10-7-15-5-3-4-6-16(15)13-20/h3-6,19H,7-14H2,1-2H3/p+1