2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Systemtic Name: 2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C18H23N2O+ MolecularWeight: 283.38802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)C[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)C[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H22N2O/c1-13-10-17(14(2)19(13)3)18(21)12-20-9-8-15-6-4-5-7-16(15)11-20/h4-7,10H,8-9,11-12H2,1-3H3/p+1