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

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-nitro-benzamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-3-nitro-benzamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-3-nitrobenzamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-3-nitrobenzamide Traditional Name: N-[1-(4-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-3-nitro-benzamide Formula: C19H17ClN4O3 MolecularWeight: 384.81628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)Cl)C)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)Cl)C)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

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