N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N,3-dimethyl-4-nitro-benzamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N,3-dimethyl-4-nitro-benzamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N,3-dimethyl-4-nitro-benzamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-N,3-dimethyl-4-nitrobenzamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N,3-dimethyl-4-nitrobenzamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N,3-dimethyl-4-nitro-benzamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O3/c1-14-12-17(10-11-20(14)25(27)28)21(26)23(4)13-19-15(2)22-24(16(19)3)18-8-6-5-7-9-18/h5-12H,13H2,1-4H3