methyl 2-[4-(4-bromanylphenoxy)butanoylamino]benzoate

Systemtic Name: methyl 2-[4-(4-bromanylphenoxy)butanoylamino]benzoate Openeye Name: methyl 2-[4-(4-bromophenoxy)butanoylamino]benzoate CAS Name: 2-[[4-(4-bromophenoxy)-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(4-bromophenoxy)butanoylamino]benzoate Traditional Name: 2-[4-(4-bromophenoxy)butanoylamino]benzoic acid methyl ester Formula: C18H18BrNO4 MolecularWeight: 392.24382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCCOC2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrNO4/c1-23-18(22)15-5-2-3-6-16(15)20-17(21)7-4-12-24-14-10-8-13(19)9-11-14/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,20,21)