butyl 3-[4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoylamino]benzoate

Systemtic Name: butyl 3-[4-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)butanoylamino]benzoate Openeye Name: butyl 3-[4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butanoylamino]benzoate CAS Name: 3-[[4-(2-bromo-4-chloro-3,5-dimethylphenoxy)-1-oxobutyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[4-(2-bromo-4-chloro-3,5-dimethylphenoxy)butanoylamino]benzoate Traditional Name: 3-[4-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)butanoylamino]benzoic acid butyl ester Formula: C23H27BrClNO4 MolecularWeight: 496.82178

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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)Cl)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C23H27BrClNO4/c1-4-5-11-30-23(28)17-8-6-9-18(14-17)26-20(27)10-7-12-29-19-13-15(2)22(25)16(3)21(19)24/h6,8-9,13-14H,4-5,7,10-12H2,1-3H3,(H,26,27)