2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(3-methoxy-5-nitrophenyl)acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(3-methoxy-5-nitrophenyl)acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-methoxy-5-nitro-phenyl)acetamide Formula: C14H15N5O6 MolecularWeight: 349.2988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC(=CC(=C2)OC)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC(=CC(=C2)OC)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O6/c1-8-14(19(23)24)9(2)17(16-8)7-13(20)15-10-4-11(18(21)22)6-12(5-10)25-3/h4-6H,7H2,1-3H3,(H,15,20)