N-(3,5-dimethyl-1-naphthalen-2-yl-pyrazol-4-yl)-3-nitro-benzamide

Systemtic Name: N-(3,5-dimethyl-1-naphthalen-2-yl-pyrazol-4-yl)-3-nitro-benzamide Openeye Name: N-[3,5-dimethyl-1-(2-naphthyl)pyrazol-4-yl]-3-nitro-benzamide CAS Name: N-[3,5-dimethyl-1-(2-naphthalenyl)-4-pyrazolyl]-3-nitrobenzamide IUPAC Name: N-(3,5-dimethyl-1-naphthalen-2-ylpyrazol-4-yl)-3-nitrobenzamide Traditional Name: N-[3,5-dimethyl-1-(2-naphthyl)pyrazol-4-yl]-3-nitro-benzamide Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC3=CC=CC=C3C=C2)C)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC3=CC=CC=C3C=C2)C)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O3/c1-14-21(23-22(27)18-8-5-9-20(13-18)26(28)29)15(2)25(24-14)19-11-10-16-6-3-4-7-17(16)12-19/h3-13H,1-2H3,(H,23,27)