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

Systemtic Name: N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-3-methyl-4-nitro-benzamide Openeye Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-3-methyl-4-nitro-benzamide CAS Name: N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-3-methyl-4-nitrobenzamide Traditional Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-3-methyl-4-nitro-benzamide Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=C(N(N=C2C)CC3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=C(N(N=C2C)CC3=CC=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3/c1-13-11-17(9-10-18(13)24(26)27)20(25)21-19-14(2)22-23(15(19)3)12-16-7-5-4-6-8-16/h4-11H,12H2,1-3H3,(H,21,25)