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

Systemtic Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Openeye Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone CAS Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone IUPAC Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Traditional Name: 1-(3-phenyl-2-pyrazolin-1-yl)-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanone Formula: C20H22N3O+ MolecularWeight: 320.40818

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CC(=O)N3CCC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CC(=O)N3CCC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O/c24-20(15-22-12-10-16-6-4-5-9-18(16)14-22)23-13-11-19(21-23)17-7-2-1-3-8-17/h1-9H,10-15H2/p+1