N-[(3,4-diethoxyphenyl)methyl]-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-3-(4-iodo-3-methyl-pyrazol-1-yl)propanamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-3-(4-iodo-3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-3-(4-iodo-3-methylpyrazol-1-yl)propanamide Traditional Name: N-(3,4-diethoxybenzyl)-3-(4-iodo-3-methyl-pyrazol-1-yl)propionamide Formula: C18H24IN3O3 MolecularWeight: 457.30593

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)CCN2C=C(C(=N2)C)I)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)CCN2C=C(C(=N2)C)I)OCC

InChI

InChI=1S/C18H24IN3O3/c1-4-24-16-7-6-14(10-17(16)25-5-2)11-20-18(23)8-9-22-12-15(19)13(3)21-22/h6-7,10,12H,4-5,8-9,11H2,1-3H3,(H,20,23)