4-iodanyl-1-methyl-N-[3-(2-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide

Systemtic Name: 4-iodanyl-1-methyl-N-[3-(2-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Openeye Name: 4-iodo-1-methyl-N-[3-(2-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide CAS Name: 4-iodo-1-methyl-N-[3-(2-methylphenoxy)-5-nitrophenyl]-3-pyrazolecarboxamide IUPAC Name: 4-iodo-1-methyl-N-[3-(2-methylphenoxy)-5-nitrophenyl]pyrazole-3-carboxamide Traditional Name: 4-iodo-1-methyl-N-[3-(2-methylphenoxy)-5-nitro-phenyl]pyrazole-3-carboxamide Formula: C18H15IN4O4 MolecularWeight: 478.24057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3I)C

Isomeric SMILES

CC1=CC=CC=C1OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=NN(C=C3I)C

InChI

InChI=1S/C18H15IN4O4/c1-11-5-3-4-6-16(11)27-14-8-12(7-13(9-14)23(25)26)20-18(24)17-15(19)10-22(2)21-17/h3-10H,1-2H3,(H,20,24)