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

Systemtic Name: 3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]-N-pentan-2-yl-propanamide Openeye Name: N-(1-methylbutyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide CAS Name: 3-[2-nitro-4-(trifluoromethyl)anilino]-N-pentan-2-ylpropanamide IUPAC Name: 3-[2-nitro-4-(trifluoromethyl)anilino]-N-pentan-2-ylpropanamide Traditional Name: N-(1-methylbutyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propionamide Formula: C15H20F3N3O3 MolecularWeight: 347.33281

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CCNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCCC(C)NC(=O)CCNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H20F3N3O3/c1-3-4-10(2)20-14(22)7-8-19-12-6-5-11(15(16,17)18)9-13(12)21(23)24/h5-6,9-10,19H,3-4,7-8H2,1-2H3,(H,20,22)