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

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-(2-methoxy-5-nitro-phenyl)benzamide Openeye Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(2-methoxy-5-nitro-phenyl)benzamide CAS Name: 4-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-(2-methoxy-5-nitrophenyl)benzamide IUPAC Name: 4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-(2-methoxy-5-nitrophenyl)benzamide Traditional Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-(2-methoxy-5-nitro-phenyl)benzamide Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)C)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])OC)C)Cl

InChI

InChI=1S/C19H17ClN4O4/c1-11-18(20)12(2)23(22-11)14-6-4-13(5-7-14)19(25)21-16-10-15(24(26)27)8-9-17(16)28-3/h4-10H,1-3H3,(H,21,25)