2-(2-methylphenoxy)-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]ethanamide

Systemtic Name: 2-(2-methylphenoxy)-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]ethanamide Openeye Name: N-[(E)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]-2-(2-methylphenoxy)acetamide CAS Name: 2-(2-methylphenoxy)-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]acetamide IUPAC Name: 2-(2-methylphenoxy)-N-[(E)-1-(3-nitro-1,2,4-triazol-1-yl)propan-2-ylideneamino]acetamide Traditional Name: N-[(E)-[1-methyl-2-(3-nitro-1,2,4-triazol-1-yl)ethylidene]amino]-2-(2-methylphenoxy)acetamide Formula: C14H16N6O4 MolecularWeight: 332.31464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NN=C(C)CN2C=NC(=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)N/N=C(\C)/CN2C=NC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N6O4/c1-10-5-3-4-6-12(10)24-8-13(21)17-16-11(2)7-19-9-15-14(18-19)20(22)23/h3-6,9H,7-8H2,1-2H3,(H,17,21)/b16-11+