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

Systemtic Name: N-[2-(1,2-oxazol-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-1-phenyl-cyclopropane-1-carboxamide Openeye Name: N-[2-(isoxazol-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-1-phenyl-cyclopropanecarboxamide CAS Name: N-[2-(3-isoxazolylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-1-phenyl-1-cyclopropanecarboxamide IUPAC Name: N-[2-(1,2-oxazol-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-1-phenylcyclopropane-1-carboxamide Traditional Name: N-[2-(isoxazol-3-ylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl]-1-phenyl-cyclopropanecarboxamide Formula: C23H24N3O2+ MolecularWeight: 374.45556

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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=NOC=C5

Isomeric SMILES

C1C[NH+](CC2=C1C=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4)CC5=NOC=C5

InChI

InChI=1S/C23H23N3O2/c27-22(23(10-11-23)19-4-2-1-3-5-19)24-20-7-6-17-8-12-26(15-18(17)14-20)16-21-9-13-28-25-21/h1-7,9,13-14H,8,10-12,15-16H2,(H,24,27)/p+1