3,4-dihydro-1H-isoquinolin-2-yl-(2-pyrrolidin-1-ylpyridin-1-ium-3-yl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-pyrrolidin-1-ylpyridin-1-ium-3-yl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-pyrrolidin-1-ylpyridin-1-ium-3-yl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-pyrrolidin-1-ylpyridin-1-ium-3-yl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(2-pyrrolidinopyridin-1-ium-3-yl)methanone Formula: C19H22N3O+ MolecularWeight: 308.39748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=[NH+]2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H21N3O/c23-19(22-13-9-15-6-1-2-7-16(15)14-22)17-8-5-10-20-18(17)21-11-3-4-12-21/h1-2,5-8,10H,3-4,9,11-14H2/p+1