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

Systemtic Name: 3,4-bis(chloranyl)-N-[(E)-1-(5-methyl-3-nitro-pyrazol-1-yl)propan-2-ylideneamino]benzamide Openeye Name: 3,4-dichloro-N-[(E)-[1-methyl-2-(5-methyl-3-nitro-pyrazol-1-yl)ethylidene]amino]benzamide CAS Name: 3,4-dichloro-N-[(E)-1-(5-methyl-3-nitro-1-pyrazolyl)propan-2-ylideneamino]benzamide IUPAC Name: 3,4-dichloro-N-[(E)-1-(5-methyl-3-nitropyrazol-1-yl)propan-2-ylideneamino]benzamide Traditional Name: 3,4-dichloro-N-[(E)-[1-methyl-2-(5-methyl-3-nitro-pyrazol-1-yl)ethylidene]amino]benzamide Formula: C14H13Cl2N5O3 MolecularWeight: 370.19072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13Cl2N5O3/c1-8(7-20-9(2)5-13(19-20)21(23)24)17-18-14(22)10-3-4-11(15)12(16)6-10/h3-6H,7H2,1-2H3,(H,18,22)/b17-8+