3-methyl-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]-2-oxidanyl-benzamide

Systemtic Name: 3-methyl-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]-2-oxidanyl-benzamide Openeye Name: 2-hydroxy-3-methyl-N-[(E)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]benzamide CAS Name: 2-hydroxy-3-methyl-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]benzamide IUPAC Name: 2-hydroxy-3-methyl-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]benzamide Traditional Name: 2-hydroxy-3-methyl-N-[(E)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]benzamide Formula: C13H14N6O4 MolecularWeight: 318.28806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)NN=C(C)CN2C=NC(=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)N/N=C(\C)/CN2C=NC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N6O4/c1-8-4-3-5-10(11(8)20)12(21)16-15-9(2)6-18-7-14-13(17-18)19(22)23/h3-5,7,20H,6H2,1-2H3,(H,16,21)/b15-9+