cyclohexyl 4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]benzoate

Systemtic Name: cyclohexyl 4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]benzoate Openeye Name: cyclohexyl 4-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]benzoate CAS Name: 4-[[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]benzoic acid cyclohexyl ester Formula: C25H30BrNO4 MolecularWeight: 488.414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)NC2=CC=C(C=C2)C(=O)OC3CCCCC3

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Br)OCC(=O)NC2=CC=C(C=C2)C(=O)OC3CCCCC3

InChI

InChI=1S/C25H30BrNO4/c1-25(2,3)21-15-18(26)11-14-22(21)30-16-23(28)27-19-12-9-17(10-13-19)24(29)31-20-7-5-4-6-8-20/h9-15,20H,4-8,16H2,1-3H3,(H,27,28)