butyl 3-[4-(2-bromanyl-4-tert-butyl-phenoxy)butanoylamino]benzoate

Systemtic Name: butyl 3-[4-(2-bromanyl-4-tert-butyl-phenoxy)butanoylamino]benzoate Openeye Name: butyl 3-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]benzoate CAS Name: 3-[[4-(2-bromo-4-tert-butylphenoxy)-1-oxobutyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[4-(2-bromo-4-tert-butylphenoxy)butanoylamino]benzoate Traditional Name: 3-[4-(2-bromo-4-tert-butyl-phenoxy)butanoylamino]benzoic acid butyl ester Formula: C25H32BrNO4 MolecularWeight: 490.42988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CCCOC2=C(C=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CCCOC2=C(C=C(C=C2)C(C)(C)C)Br

InChI

InChI=1S/C25H32BrNO4/c1-5-6-14-31-24(29)18-9-7-10-20(16-18)27-23(28)11-8-15-30-22-13-12-19(17-21(22)26)25(2,3)4/h7,9-10,12-13,16-17H,5-6,8,11,14-15H2,1-4H3,(H,27,28)