N-[3-[6-acetamido-4-(trifluoromethyl)pyridin-2-yl]oxypropyl]-2-chloranyl-5-nitro-benzamide

Systemtic Name: N-[3-[6-acetamido-4-(trifluoromethyl)pyridin-2-yl]oxypropyl]-2-chloranyl-5-nitro-benzamide Openeye Name: N-[3-[[6-acetamido-4-(trifluoromethyl)-2-pyridyl]oxy]propyl]-2-chloro-5-nitro-benzamide CAS Name: N-[3-[[6-acetamido-4-(trifluoromethyl)-2-pyridinyl]oxy]propyl]-2-chloro-5-nitrobenzamide IUPAC Name: N-[3-[6-acetamido-4-(trifluoromethyl)pyridin-2-yl]oxypropyl]-2-chloro-5-nitrobenzamide Traditional Name: N-[3-[[6-acetamido-4-(trifluoromethyl)-2-pyridyl]oxy]propyl]-2-chloro-5-nitro-benzamide Formula: C18H16ClF3N4O5 MolecularWeight: 460.79165

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CC(=C1)C(F)(F)F)OCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)NC1=NC(=CC(=C1)C(F)(F)F)OCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H16ClF3N4O5/c1-10(27)24-15-7-11(18(20,21)22)8-16(25-15)31-6-2-5-23-17(28)13-9-12(26(29)30)3-4-14(13)19/h3-4,7-9H,2,5-6H2,1H3,(H,23,28)(H,24,25,27)