[3-bromanyl-5-[2-(ethoxycarbonylamino)ethyl]-2-phenylmethoxy-phenyl] ethyl carbonate

Systemtic Name: [3-bromanyl-5-[2-(ethoxycarbonylamino)ethyl]-2-phenylmethoxy-phenyl] ethyl carbonate Openeye Name: [2-benzyloxy-3-bromo-5-[2-(ethoxycarbonylamino)ethyl]phenyl] ethyl carbonate CAS Name: carbonic acid [3-bromo-5-[2-(ethoxycarbonylamino)ethyl]-2-phenylmethoxyphenyl] ethyl ester IUPAC Name: [3-bromo-5-[2-(ethoxycarbonylamino)ethyl]-2-phenylmethoxyphenyl] ethyl carbonate Traditional Name: carbonic acid [2-benzoxy-3-bromo-5-[2-(carbethoxyamino)ethyl]phenyl] ethyl ester Formula: C21H24BrNO6 MolecularWeight: 466.32236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NCCC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)OC(=O)OCC

Isomeric SMILES

CCOC(=O)NCCC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)OC(=O)OCC

InChI

InChI=1S/C21H24BrNO6/c1-3-26-20(24)23-11-10-16-12-17(22)19(18(13-16)29-21(25)27-4-2)28-14-15-8-6-5-7-9-15/h5-9,12-13H,3-4,10-11,14H2,1-2H3,(H,23,24)