4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-N-(6-piperidin-1-ylpyridin-1-ium-3-yl)benzamide

Systemtic Name: 4-[bis(fluoranyl)methoxy]-5-methoxy-2-nitro-N-(6-piperidin-1-ylpyridin-1-ium-3-yl)benzamide Openeye Name: 4-(difluoromethoxy)-5-methoxy-2-nitro-N-[6-(1-piperidyl)pyridin-1-ium-3-yl]benzamide CAS Name: 4-(difluoromethoxy)-5-methoxy-2-nitro-N-[6-(1-piperidinyl)-3-pyridin-1-iumyl]benzamide IUPAC Name: 4-(difluoromethoxy)-5-methoxy-2-nitro-N-(6-piperidin-1-ylpyridin-1-ium-3-yl)benzamide Traditional Name: 4-(difluoromethoxy)-5-methoxy-2-nitro-N-(6-piperidinopyridin-1-ium-3-yl)benzamide Formula: C19H21F2N4O5+ MolecularWeight: 423.390646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=C[NH+]=C(C=C2)N3CCCCC3)[N+](=O)[O-])OC(F)F

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=C[NH+]=C(C=C2)N3CCCCC3)[N+](=O)[O-])OC(F)F

InChI

InChI=1S/C19H20F2N4O5/c1-29-15-9-13(14(25(27)28)10-16(15)30-19(20)21)18(26)23-12-5-6-17(22-11-12)24-7-3-2-4-8-24/h5-6,9-11,19H,2-4,7-8H2,1H3,(H,23,26)/p+1