N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(5-ethanoyl-2-methoxy-phenyl)ethanamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(5-ethanoyl-2-methoxy-phenyl)ethanamide Openeye Name: 2-(5-acetyl-2-methoxy-phenyl)-N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]acetamide CAS Name: 2-(5-acetyl-2-methoxyphenyl)-N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]acetamide IUPAC Name: 2-(5-acetyl-2-methoxyphenyl)-N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]acetamide Traditional Name: 2-(5-acetyl-2-methoxy-phenyl)-N-[2-(4-bromobenzyl)pyrazol-3-yl]acetamide Formula: C21H20BrN3O3 MolecularWeight: 442.3058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)NC2=CC=NN2CC3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)NC2=CC=NN2CC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20BrN3O3/c1-14(26)16-5-8-19(28-2)17(11-16)12-21(27)24-20-9-10-23-25(20)13-15-3-6-18(22)7-4-15/h3-11H,12-13H2,1-2H3,(H,24,27)