N-[3-(3,5-dimethylpyrazol-1-yl)-2-methyl-propyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)-2-methyl-propyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)-2-methyl-propyl]-3-methyl-4-nitro-benzamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)-2-methylpropyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)-2-methylpropyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)-2-methyl-propyl]-3-methyl-4-nitro-benzamide Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O3/c1-11(10-20-14(4)8-13(3)19-20)9-18-17(22)15-5-6-16(21(23)24)12(2)7-15/h5-8,11H,9-10H2,1-4H3,(H,18,22)