4-nitro-N-[3-oxidanylidene-3-(1H-1,2,4-triazol-5-ylamino)propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-(1H-1,2,4-triazol-5-ylamino)propyl]benzamide Openeye Name: 4-nitro-N-[3-oxo-3-(1H-1,2,4-triazol-5-ylamino)propyl]benzamide CAS Name: 4-nitro-N-[3-oxo-3-(1H-1,2,4-triazol-5-ylamino)propyl]benzamide IUPAC Name: 4-nitro-N-[3-oxo-3-(1H-1,2,4-triazol-5-ylamino)propyl]benzamide Traditional Name: N-[3-keto-3-(1H-1,2,4-triazol-5-ylamino)propyl]-4-nitro-benzamide Formula: C12H12N6O4 MolecularWeight: 304.26148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCC(=O)NC2=NC=NN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCC(=O)NC2=NC=NN2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N6O4/c19-10(16-12-14-7-15-17-12)5-6-13-11(20)8-1-3-9(4-2-8)18(21)22/h1-4,7H,5-6H2,(H,13,20)(H2,14,15,16,17,19)