N-[(1,3-diphenylpyrazol-4-yl)methyl]-N,2-dimethyl-3-nitro-benzamide

Systemtic Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-N,2-dimethyl-3-nitro-benzamide Openeye Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-N,2-dimethyl-3-nitro-benzamide CAS Name: N-[(1,3-diphenyl-4-pyrazolyl)methyl]-N,2-dimethyl-3-nitrobenzamide IUPAC Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-N,2-dimethyl-3-nitrobenzamide Traditional Name: N-[(1,3-diphenylpyrazol-4-yl)methyl]-N,2-dimethyl-3-nitro-benzamide Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N(C)CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O3/c1-18-22(14-9-15-23(18)29(31)32)25(30)27(2)16-20-17-28(21-12-7-4-8-13-21)26-24(20)19-10-5-3-6-11-19/h3-15,17H,16H2,1-2H3