N-[5-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-2-methyl-phenyl]cyclopropanecarboxamide

Systemtic Name: N-[5-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-2-methyl-phenyl]cyclopropanecarboxamide Openeye Name: N-[5-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-2-methyl-phenyl]cyclopropanecarboxamide CAS Name: N-[5-[[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethyl]amino]-2-methylphenyl]cyclopropanecarboxamide IUPAC Name: N-[5-[[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]-2-methylphenyl]cyclopropanecarboxamide Traditional Name: N-[5-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-2-methyl-phenyl]cyclopropanecarboxamide Formula: C23H27BrN2O3 MolecularWeight: 459.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C)NC(=O)C3CC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C)NC(=O)C3CC3

InChI

InChI=1S/C23H27BrN2O3/c1-14-5-9-17(12-19(14)26-22(28)15-6-7-15)25-21(27)13-29-20-10-8-16(24)11-18(20)23(2,3)4/h5,8-12,15H,6-7,13H2,1-4H3,(H,25,27)(H,26,28)