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

Systemtic Name: 1-phenyl-N-[2-(3-pyrazol-1-ylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropane-1-carboxamide Openeye Name: 1-phenyl-N-[2-(3-pyrazol-1-ylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropanecarboxamide CAS Name: 1-phenyl-N-[2-[3-(1-pyrazolyl)propyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-1-cyclopropanecarboxamide IUPAC Name: 1-phenyl-N-[2-(3-pyrazol-1-ylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropane-1-carboxamide Traditional Name: 1-phenyl-N-[2-(3-pyrazol-1-ylpropyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]cyclopropanecarboxamide Formula: C25H29N4O+ MolecularWeight: 401.52396

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C1C=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4)CCCN5C=CC=N5

Isomeric SMILES

C1C[NH+](CC2=C1C=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4)CCCN5C=CC=N5

InChI

InChI=1S/C25H28N4O/c30-24(25(11-12-25)22-6-2-1-3-7-22)27-23-9-8-20-10-17-28(19-21(20)18-23)14-5-16-29-15-4-13-26-29/h1-4,6-9,13,15,18H,5,10-12,14,16-17,19H2,(H,27,30)/p+1