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

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(2-methoxy-5-nitro-phenoxy)ethanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(2-methoxy-5-nitro-phenoxy)acetamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-(2-methoxy-5-nitrophenoxy)acetamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-(2-methoxy-5-nitrophenoxy)acetamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(2-methoxy-5-nitro-phenoxy)acetamide Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)COC3=C(C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)COC3=C(C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H20N4O5/c1-13-20(14(2)23(22-13)15-7-5-4-6-8-15)21-19(25)12-29-18-11-16(24(26)27)9-10-17(18)28-3/h4-11H,12H2,1-3H3,(H,21,25)