3-(4-iodanyl-3-methyl-pyrazol-1-yl)-N-(3-nitro-5-pyridin-3-yloxy-phenyl)propanamide

Systemtic Name: 3-(4-iodanyl-3-methyl-pyrazol-1-yl)-N-(3-nitro-5-pyridin-3-yloxy-phenyl)propanamide Openeye Name: 3-(4-iodo-3-methyl-pyrazol-1-yl)-N-[3-nitro-5-(3-pyridyloxy)phenyl]propanamide CAS Name: 3-(4-iodo-3-methyl-1-pyrazolyl)-N-[3-nitro-5-(3-pyridinyloxy)phenyl]propanamide IUPAC Name: 3-(4-iodo-3-methylpyrazol-1-yl)-N-(3-nitro-5-pyridin-3-yloxyphenyl)propanamide Traditional Name: 3-(4-iodo-3-methyl-pyrazol-1-yl)-N-[3-nitro-5-(3-pyridyloxy)phenyl]propionamide Formula: C18H16IN5O4 MolecularWeight: 493.25521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1I)CCC(=O)NC2=CC(=CC(=C2)OC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C=C1I)CCC(=O)NC2=CC(=CC(=C2)OC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16IN5O4/c1-12-17(19)11-23(22-12)6-4-18(25)21-13-7-14(24(26)27)9-16(8-13)28-15-3-2-5-20-10-15/h2-3,5,7-11H,4,6H2,1H3,(H,21,25)