N-[4-fluoranyl-2-nitro-5-[3-(1,2,4-triazol-1-yl)propylamino]phenyl]ethanamide

Systemtic Name: N-[4-fluoranyl-2-nitro-5-[3-(1,2,4-triazol-1-yl)propylamino]phenyl]ethanamide Openeye Name: N-[4-fluoro-2-nitro-5-[3-(1,2,4-triazol-1-yl)propylamino]phenyl]acetamide CAS Name: N-[4-fluoro-2-nitro-5-[3-(1,2,4-triazol-1-yl)propylamino]phenyl]acetamide IUPAC Name: N-[4-fluoro-2-nitro-5-[3-(1,2,4-triazol-1-yl)propylamino]phenyl]acetamide Traditional Name: N-[4-fluoro-2-nitro-5-[3-(1,2,4-triazol-1-yl)propylamino]phenyl]acetamide Formula: C13H15FN6O3 MolecularWeight: 322.295003

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1[N+](=O)[O-])F)NCCCN2C=NC=N2

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1[N+](=O)[O-])F)NCCCN2C=NC=N2

InChI

InChI=1S/C13H15FN6O3/c1-9(21)18-12-6-11(10(14)5-13(12)20(22)23)16-3-2-4-19-8-15-7-17-19/h5-8,16H,2-4H2,1H3,(H,18,21)