4-chloranyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-nitro-benzamide Openeye Name: 4-chloro-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-nitro-benzamide CAS Name: 4-chloro-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2-nitrobenzamide IUPAC Name: 4-chloro-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2-nitrobenzamide Traditional Name: 4-chloro-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-nitro-benzamide Formula: C19H17ClN4O3 MolecularWeight: 384.81628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H17ClN4O3/c1-12-17(13(2)23(22-12)15-6-4-3-5-7-15)11-21-19(25)16-9-8-14(20)10-18(16)24(26)27/h3-10H,11H2,1-2H3,(H,21,25)