3,4-bis(chloranyl)-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-nitro-benzamide

Systemtic Name: 3,4-bis(chloranyl)-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-nitro-benzamide Openeye Name: 3,4-dichloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-nitro-benzamide CAS Name: 3,4-dichloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-nitrobenzamide IUPAC Name: 3,4-dichloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-nitrobenzamide Traditional Name: 3,4-dichloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)-5-nitro-benzamide Formula: C12H10Cl2N4O3 MolecularWeight: 329.1388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NC(=O)C2=CC(=C(C(=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C)NC(=O)C2=CC(=C(C(=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H10Cl2N4O3/c1-5-11(6(2)17-16-5)15-12(19)7-3-8(13)10(14)9(4-7)18(20)21/h3-4H,1-2H3,(H,15,19)(H,16,17)