cyclohexyl 4-[4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoylamino]benzoate

Systemtic Name: cyclohexyl 4-[4-(2-bromanyl-4-propan-2-yl-phenoxy)butanoylamino]benzoate Openeye Name: cyclohexyl 4-[4-(2-bromo-4-isopropyl-phenoxy)butanoylamino]benzoate CAS Name: 4-[[4-(2-bromo-4-propan-2-ylphenoxy)-1-oxobutyl]amino]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[4-(2-bromo-4-propan-2-ylphenoxy)butanoylamino]benzoate Traditional Name: 4-[4-(2-bromo-4-isopropyl-phenoxy)butanoylamino]benzoic acid cyclohexyl ester Formula: C26H32BrNO4 MolecularWeight: 502.44058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32BrNO4/c1-18(2)20-12-15-24(23(27)17-20)31-16-6-9-25(29)28-21-13-10-19(11-14-21)26(30)32-22-7-4-3-5-8-22/h10-15,17-18,22H,3-9,16H2,1-2H3,(H,28,29)