N-(3-ethanoylphenyl)-3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanamide

Systemtic Name: N-(3-ethanoylphenyl)-3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanamide Openeye Name: N-(3-acetylphenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide CAS Name: N-(3-acetylphenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide IUPAC Name: N-(3-acetylphenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide Traditional Name: N-(3-acetylphenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propionamide Formula: C18H16F3N3O4 MolecularWeight: 395.33255

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H16F3N3O4/c1-11(25)12-3-2-4-14(9-12)23-17(26)7-8-22-15-6-5-13(18(19,20)21)10-16(15)24(27)28/h2-6,9-10,22H,7-8H2,1H3,(H,23,26)