1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone

Systemtic Name: 1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Openeye Name: 1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone CAS Name: 1-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone IUPAC Name: 1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Traditional Name: 1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Formula: C20H24N3O2+ MolecularWeight: 338.42346

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)C[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC(=CN2)C(=O)C[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H23N3O2/c24-19(14-22-10-7-15-5-1-2-6-16(15)13-22)17-11-18(21-12-17)20(25)23-8-3-4-9-23/h1-2,5-6,11-12,21H,3-4,7-10,13-14H2/p+1