N-[(3,4-diethoxyphenyl)methyl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-4-iodanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-4-iodo-1-methyl-pyrazole-3-carboxamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-4-iodo-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-4-iodo-1-methylpyrazole-3-carboxamide Traditional Name: N-(3,4-diethoxybenzyl)-4-iodo-1-methyl-pyrazole-3-carboxamide Formula: C16H20IN3O3 MolecularWeight: 429.25277

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2=NN(C=C2I)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2=NN(C=C2I)C)OCC

InChI

InChI=1S/C16H20IN3O3/c1-4-22-13-7-6-11(8-14(13)23-5-2)9-18-16(21)15-12(17)10-20(3)19-15/h6-8,10H,4-5,9H2,1-3H3,(H,18,21)