[5-[(3-chlorophenyl)methyl]-2-nitro-phenyl]-(4-iodanyl-2-methyl-pyrazol-3-yl)methanone

Systemtic Name: [5-[(3-chlorophenyl)methyl]-2-nitro-phenyl]-(4-iodanyl-2-methyl-pyrazol-3-yl)methanone Openeye Name: [5-[(3-chlorophenyl)methyl]-2-nitro-phenyl]-(4-iodo-2-methyl-pyrazol-3-yl)methanone CAS Name: [5-[(3-chlorophenyl)methyl]-2-nitrophenyl]-(4-iodo-2-methyl-3-pyrazolyl)methanone IUPAC Name: [5-[(3-chlorophenyl)methyl]-2-nitrophenyl]-(4-iodo-2-methylpyrazol-3-yl)methanone Traditional Name: [5-(3-chlorobenzyl)-2-nitro-phenyl]-(4-iodo-2-methyl-pyrazol-3-yl)methanone Formula: C18H13ClIN3O3 MolecularWeight: 481.67159

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)I)C(=O)C2=C(C=CC(=C2)CC3=CC(=CC=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C(=C(C=N1)I)C(=O)C2=C(C=CC(=C2)CC3=CC(=CC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClIN3O3/c1-22-17(15(20)10-21-22)18(24)14-9-12(5-6-16(14)23(25)26)7-11-3-2-4-13(19)8-11/h2-6,8-10H,7H2,1H3