4-(3,5-dimethylpyrazol-1-yl)-N-(4-fluoranyl-3-nitro-phenyl)benzamide hydrochloride

Systemtic Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(4-fluoranyl-3-nitro-phenyl)benzamide hydrochloride Openeye Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(4-fluoro-3-nitro-phenyl)benzamide hydrochloride CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)-N-(4-fluoro-3-nitrophenyl)benzamide hydrochloride IUPAC Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(4-fluoro-3-nitrophenyl)benzamide hydrochloride Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(4-fluoro-3-nitro-phenyl)benzamide hydrochloride Formula: C18H16ClFN4O3 MolecularWeight: 390.796043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15FN4O3.ClH/c1-11-9-12(2)22(21-11)15-6-3-13(4-7-15)18(24)20-14-5-8-16(19)17(10-14)23(25)26;/h3-10H,1-2H3,(H,20,24);1H