N-[5-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-2-methyl-phenyl]cyclopropanecarboxamide

Systemtic Name: N-[5-[2-(4-bromanyl-2,6-dimethyl-phenoxy)ethanoylamino]-2-methyl-phenyl]cyclopropanecarboxamide Openeye Name: N-[5-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-2-methyl-phenyl]cyclopropanecarboxamide CAS Name: N-[5-[[2-(4-bromo-2,6-dimethylphenoxy)-1-oxoethyl]amino]-2-methylphenyl]cyclopropanecarboxamide IUPAC Name: N-[5-[[2-(4-bromo-2,6-dimethylphenoxy)acetyl]amino]-2-methylphenyl]cyclopropanecarboxamide Traditional Name: N-[5-[[2-(4-bromo-2,6-dimethyl-phenoxy)acetyl]amino]-2-methyl-phenyl]cyclopropanecarboxamide Formula: C21H23BrN2O3 MolecularWeight: 431.32292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2C)Br)C)NC(=O)C3CC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2C)Br)C)NC(=O)C3CC3

InChI

InChI=1S/C21H23BrN2O3/c1-12-4-7-17(10-18(12)24-21(26)15-5-6-15)23-19(25)11-27-20-13(2)8-16(22)9-14(20)3/h4,7-10,15H,5-6,11H2,1-3H3,(H,23,25)(H,24,26)