(phenylmethyl) 2-[4-(4-bromanylphenoxy)butanoylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[4-(4-bromanylphenoxy)butanoylamino]ethanoate Openeye Name: benzyl 2-[4-(4-bromophenoxy)butanoylamino]acetate CAS Name: 2-[[4-(4-bromophenoxy)-1-oxobutyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-(4-bromophenoxy)butanoylamino]acetate Traditional Name: 2-[4-(4-bromophenoxy)butanoylamino]acetic acid benzyl ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrNO4/c20-16-8-10-17(11-9-16)24-12-4-7-18(22)21-13-19(23)25-14-15-5-2-1-3-6-15/h1-3,5-6,8-11H,4,7,12-14H2,(H,21,22)