N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanamide Openeye Name: 2-(4-allyl-2-methoxy-phenoxy)-N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]acetamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(2-methoxy-4-prop-2-enylphenoxy)acetamide Traditional Name: 2-(4-allyl-2-methoxy-phenoxy)-N-[2-(4-bromobenzyl)pyrazol-3-yl]acetamide Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCC(=O)NC2=CC=NN2CC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCC(=O)NC2=CC=NN2CC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H22BrN3O3/c1-3-4-16-7-10-19(20(13-16)28-2)29-15-22(27)25-21-11-12-24-26(21)14-17-5-8-18(23)9-6-17/h3,5-13H,1,4,14-15H2,2H3,(H,25,27)