N-[(E)-1-(5-methyl-3-nitro-pyrazol-1-yl)propan-2-ylideneamino]-2,4-bis(oxidanyl)benzamide

Systemtic Name: N-[(E)-1-(5-methyl-3-nitro-pyrazol-1-yl)propan-2-ylideneamino]-2,4-bis(oxidanyl)benzamide Openeye Name: 2,4-dihydroxy-N-[(E)-[1-methyl-2-(5-methyl-3-nitro-pyrazol-1-yl)ethylidene]amino]benzamide CAS Name: 2,4-dihydroxy-N-[(E)-1-(5-methyl-3-nitro-1-pyrazolyl)propan-2-ylideneamino]benzamide IUPAC Name: 2,4-dihydroxy-N-[(E)-1-(5-methyl-3-nitropyrazol-1-yl)propan-2-ylideneamino]benzamide Traditional Name: 2,4-dihydroxy-N-[(E)-[1-methyl-2-(5-methyl-3-nitro-pyrazol-1-yl)ethylidene]amino]benzamide Formula: C14H15N5O5 MolecularWeight: 333.2994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=NNC(=O)C2=C(C=C(C=C2)O)O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1C/C(=N/NC(=O)C2=C(C=C(C=C2)O)O)/C)[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O5/c1-8(7-18-9(2)5-13(17-18)19(23)24)15-16-14(22)11-4-3-10(20)6-12(11)21/h3-6,20-21H,7H2,1-2H3,(H,16,22)/b15-8+