N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-N-cyclopropyl-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[[4-[bis(fluoranyl)methoxy]-3-methoxy-phenyl]methyl]-N-cyclopropyl-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-cyclopropyl-N-[[4-(difluoromethoxy)-3-methoxy-phenyl]methyl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-cyclopropyl-N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-cyclopropyl-N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-cyclopropyl-N-[4-(difluoromethoxy)-3-methoxy-benzyl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C18H18F2N2O4 MolecularWeight: 364.343326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(C2CC2)C(=O)C3=C[N+](=CC=C3)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)CN(C2CC2)C(=O)C3=C[N+](=CC=C3)[O-])OC(F)F

InChI

InChI=1S/C18H18F2N2O4/c1-25-16-9-12(4-7-15(16)26-18(19)20)10-22(14-5-6-14)17(23)13-3-2-8-21(24)11-13/h2-4,7-9,11,14,18H,5-6,10H2,1H3