N-(2-chloranyl-5-nitro-phenyl)-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-3-(4-iodo-3-methyl-pyrazol-1-yl)propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-3-(4-iodo-3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-3-(4-iodo-3-methylpyrazol-1-yl)propanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-3-(4-iodo-3-methyl-pyrazol-1-yl)propionamide Formula: C13H12ClIN4O3 MolecularWeight: 434.61685

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1I)CCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=NN(C=C1I)CCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C13H12ClIN4O3/c1-8-11(15)7-18(17-8)5-4-13(20)16-12-6-9(19(21)22)2-3-10(12)14/h2-3,6-7H,4-5H2,1H3,(H,16,20)