5-cyclopropyl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-cyclopropyl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-cyclopropyl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]isoxazole-3-carboxamide CAS Name: 5-cyclopropyl-N-[[6-(1-pyrrolidinyl)-3-pyridin-1-iumyl]methyl]-3-isoxazolecarboxamide IUPAC Name: 5-cyclopropyl-N-[(6-pyrrolidin-1-ylpyridin-1-ium-3-yl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-cyclopropyl-N-[(6-pyrrolidinopyridin-1-ium-3-yl)methyl]isoxazole-3-carboxamide Formula: C17H21N4O2+ MolecularWeight: 313.37424

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)C3=NOC(=C3)C4CC4

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=C(C=C2)CNC(=O)C3=NOC(=C3)C4CC4

InChI

InChI=1S/C17H20N4O2/c22-17(14-9-15(23-20-14)13-4-5-13)19-11-12-3-6-16(18-10-12)21-7-1-2-8-21/h3,6,9-10,13H,1-2,4-5,7-8,11H2,(H,19,22)/p+1