N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl]-4-methoxy-3-nitro-benzamide Formula: C16H14ClF3N4O4 MolecularWeight: 418.75497

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCNC2=C(C=C(C=N2)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCNC2=C(C=C(C=N2)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClF3N4O4/c1-28-13-3-2-9(6-12(13)24(26)27)15(25)22-5-4-21-14-11(17)7-10(8-23-14)16(18,19)20/h2-3,6-8H,4-5H2,1H3,(H,21,23)(H,22,25)