N-(4-iodanyl-2-methyl-phenyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-(4-iodo-2-methyl-phenyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-(4-iodo-2-methylphenyl)-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(4-iodo-2-methylphenyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-(4-iodo-2-methyl-phenyl)-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C17H13IN4O3 MolecularWeight: 448.21459

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13IN4O3/c1-11-9-12(18)5-6-15(11)19-17(23)16-7-8-21(20-16)13-3-2-4-14(10-13)22(24)25/h2-10H,1H3,(H,19,23)