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

Systemtic Name: N-(3-cyanophenyl)-3-[[2-nitro-4-(trifluoromethyl)phenyl]amino]propanamide Openeye Name: N-(3-cyanophenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide CAS Name: N-(3-cyanophenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide IUPAC Name: N-(3-cyanophenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propanamide Traditional Name: N-(3-cyanophenyl)-3-[2-nitro-4-(trifluoromethyl)anilino]propionamide Formula: C17H13F3N4O3 MolecularWeight: 378.30533

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13F3N4O3/c18-17(19,20)12-4-5-14(15(9-12)24(26)27)22-7-6-16(25)23-13-3-1-2-11(8-13)10-21/h1-5,8-9,22H,6-7H2,(H,23,25)