1-phenyl-N-[2-(1H-pyrazol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropane-1-carboxamide

Systemtic Name: 1-phenyl-N-[2-(1H-pyrazol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropane-1-carboxamide Openeye Name: 1-phenyl-N-[2-(1H-pyrazol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropanecarboxamide CAS Name: 1-phenyl-N-[2-(1H-pyrazol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-1-cyclopropanecarboxamide IUPAC Name: 1-phenyl-N-[2-(1H-pyrazol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropane-1-carboxamide Traditional Name: 1-phenyl-N-[2-(1H-pyrazol-5-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropanecarboxamide Formula: C23H25N4O+ MolecularWeight: 373.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C1C=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4)CC5=CC=NN5

Isomeric SMILES

C1C[NH+](CC2=C1C=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4)CC5=CC=NN5

InChI

InChI=1S/C23H24N4O/c28-22(23(10-11-23)19-4-2-1-3-5-19)25-20-7-6-17-9-13-27(15-18(17)14-20)16-21-8-12-24-26-21/h1-8,12,14H,9-11,13,15-16H2,(H,24,26)(H,25,28)/p+1