2-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-[(3,4-diethoxyphenyl)methyl]propanamide

Systemtic Name: 2-(4-bromanyl-3-methyl-pyrazol-1-yl)-N-[(3,4-diethoxyphenyl)methyl]propanamide Openeye Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)-N-[(3,4-diethoxyphenyl)methyl]propanamide CAS Name: 2-(4-bromo-3-methyl-1-pyrazolyl)-N-[(3,4-diethoxyphenyl)methyl]propanamide IUPAC Name: 2-(4-bromo-3-methylpyrazol-1-yl)-N-[(3,4-diethoxyphenyl)methyl]propanamide Traditional Name: 2-(4-bromo-3-methyl-pyrazol-1-yl)-N-(3,4-diethoxybenzyl)propionamide Formula: C18H24BrN3O3 MolecularWeight: 410.30546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C(C)N2C=C(C(=N2)C)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C(C)N2C=C(C(=N2)C)Br)OCC

InChI

InChI=1S/C18H24BrN3O3/c1-5-24-16-8-7-14(9-17(16)25-6-2)10-20-18(23)13(4)22-11-15(19)12(3)21-22/h7-9,11,13H,5-6,10H2,1-4H3,(H,20,23)