N-(2H-benzotriazol-4-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-(2H-benzotriazol-4-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-(2H-benzotriazol-4-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-(2H-benzotriazol-4-yl)-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(2H-benzotriazol-4-yl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide Traditional Name: N-(2H-benzotriazol-4-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide Formula: C13H13N7O3 MolecularWeight: 315.28742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=CC3=NNN=C32)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=CC3=NNN=C32)C)[N+](=O)[O-]

InChI

InChI=1S/C13H13N7O3/c1-7-13(20(22)23)8(2)19(17-7)6-11(21)14-9-4-3-5-10-12(9)16-18-15-10/h3-5H,6H2,1-2H3,(H,14,21)(H,15,16,18)