N-[3-[2-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)ethanoylamino]-4-methyl-phenyl]propanamide

Systemtic Name: N-[3-[2-(2-bromanyl-4-cyano-6-ethoxy-phenoxy)ethanoylamino]-4-methyl-phenyl]propanamide Openeye Name: N-[3-[[2-(2-bromo-4-cyano-6-ethoxy-phenoxy)acetyl]amino]-4-methyl-phenyl]propanamide CAS Name: N-[3-[[2-(2-bromo-4-cyano-6-ethoxyphenoxy)-1-oxoethyl]amino]-4-methylphenyl]propanamide IUPAC Name: N-[3-[[2-(2-bromo-4-cyano-6-ethoxyphenoxy)acetyl]amino]-4-methylphenyl]propanamide Traditional Name: N-[3-[[2-(2-bromo-4-cyano-6-ethoxy-phenoxy)acetyl]amino]-4-methyl-phenyl]propionamide Formula: C21H22BrN3O4 MolecularWeight: 460.32108

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)COC2=C(C=C(C=C2Br)C#N)OCC

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)COC2=C(C=C(C=C2Br)C#N)OCC

InChI

InChI=1S/C21H22BrN3O4/c1-4-19(26)24-15-7-6-13(3)17(10-15)25-20(27)12-29-21-16(22)8-14(11-23)9-18(21)28-5-2/h6-10H,4-5,12H2,1-3H3,(H,24,26)(H,25,27)