4-(3-nitro-1,2,4-triazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide

Systemtic Name: 4-(3-nitro-1,2,4-triazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide Openeye Name: 4-(3-nitro-1,2,4-triazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide CAS Name: 4-(3-nitro-1,2,4-triazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide IUPAC Name: 4-(3-nitro-1,2,4-triazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide Traditional Name: 4-(3-nitro-1,2,4-triazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butyramide Formula: C13H12F3N5O3 MolecularWeight: 343.26129

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CCCN2C=NC(=N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CCCN2C=NC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H12F3N5O3/c14-13(15,16)9-4-1-2-5-10(9)18-11(22)6-3-7-20-8-17-12(19-20)21(23)24/h1-2,4-5,8H,3,6-7H2,(H,18,22)