methyl 4-[4-(3-bromanylphenoxy)butanoylamino]benzoate

Systemtic Name: methyl 4-[4-(3-bromanylphenoxy)butanoylamino]benzoate Openeye Name: methyl 4-[4-(3-bromophenoxy)butanoylamino]benzoate CAS Name: 4-[[4-(3-bromophenoxy)-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(3-bromophenoxy)butanoylamino]benzoate Traditional Name: 4-[4-(3-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=C(C=C1)NC(=O)CCCOC2=CC(=CC=C2)Br

Isomeric SMILES

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

InChI

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