6-[(4-fluorophenyl)methyl-methyl-amino]-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 6-[(4-fluorophenyl)methyl-methyl-amino]-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide Openeye Name: 6-[(4-fluorophenyl)methyl-methyl-amino]-N-[(5-isopropyl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide CAS Name: 6-[(4-fluorophenyl)methyl-methylamino]-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 6-[(4-fluorophenyl)methyl-methylamino]-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide Traditional Name: 6-[(4-fluorobenzyl)-methyl-amino]-N-[(5-isopropyl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide Formula: C20H23FN5O2+ MolecularWeight: 384.427323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NO1)CNC(=O)C2=C[NH+]=C(C=C2)N(C)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C1=NC(=NO1)CNC(=O)C2=C[NH+]=C(C=C2)N(C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN5O2/c1-13(2)20-24-17(25-28-20)11-23-19(27)15-6-9-18(22-10-15)26(3)12-14-4-7-16(21)8-5-14/h4-10,13H,11-12H2,1-3H3,(H,23,27)/p+1