N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-4-nitro-benzamide

Systemtic Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-4-nitro-benzamide Openeye Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-4-nitro-benzamide CAS Name: N-[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]-4-nitrobenzamide IUPAC Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-4-nitrobenzamide Traditional Name: N-[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]-4-nitro-benzamide Formula: C20H19ClN4O3 MolecularWeight: 398.84286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3Cl

InChI

InChI=1S/C20H19ClN4O3/c1-20(2,3)17-12-18(24(23-17)16-7-5-4-6-15(16)21)22-19(26)13-8-10-14(11-9-13)25(27)28/h4-12H,1-3H3,(H,22,26)