2-chloranyl-N-[4-[6-methoxy-4-(trifluoromethyl)pyridin-2-yl]oxybutyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[4-[6-methoxy-4-(trifluoromethyl)pyridin-2-yl]oxybutyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[4-[[6-methoxy-4-(trifluoromethyl)-2-pyridyl]oxy]butyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[4-[[6-methoxy-4-(trifluoromethyl)-2-pyridinyl]oxy]butyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[4-[6-methoxy-4-(trifluoromethyl)pyridin-2-yl]oxybutyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[4-[[6-methoxy-4-(trifluoromethyl)-2-pyridyl]oxy]butyl]-5-nitro-benzamide Formula: C18H17ClF3N3O5 MolecularWeight: 447.79289

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=CC(=C1)C(F)(F)F)OCCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=NC(=CC(=C1)C(F)(F)F)OCCCCNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H17ClF3N3O5/c1-29-15-8-11(18(20,21)22)9-16(24-15)30-7-3-2-6-23-17(26)13-10-12(25(27)28)4-5-14(13)19/h4-5,8-10H,2-3,6-7H2,1H3,(H,23,26)