(phenylmethyl) 2-[3-bromanylpropyl-(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-bromanylpropyl-(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]ethanoate Openeye Name: benzyl 2-[(2-benzyloxy-2-oxo-ethyl)-(3-bromopropyl)amino]acetate CAS Name: 2-[3-bromopropyl-(2-oxo-2-phenylmethoxyethyl)amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-bromopropyl-(2-oxo-2-phenylmethoxyethyl)amino]acetate Traditional Name: 2-[(2-benzoxy-2-keto-ethyl)-(3-bromopropyl)amino]acetic acid benzyl ester Formula: C21H24BrNO4 MolecularWeight: 434.32356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CN(CCCBr)CC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CN(CCCBr)CC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24BrNO4/c22-12-7-13-23(14-20(24)26-16-18-8-3-1-4-9-18)15-21(25)27-17-19-10-5-2-6-11-19/h1-6,8-11H,7,12-17H2