ethyl 2-[[(3R)-4-bromanyl-3-(phenylmethoxycarbonylamino)butanoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[(3R)-4-bromanyl-3-(phenylmethoxycarbonylamino)butanoyl]amino]ethanoate Openeye Name: ethyl 2-[[(3R)-3-(benzyloxycarbonylamino)-4-bromo-butanoyl]amino]acetate CAS Name: 2-[[(3R)-4-bromo-1-oxo-3-(phenylmethoxycarbonylamino)butyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(3R)-4-bromo-3-(phenylmethoxycarbonylamino)butanoyl]amino]acetate Traditional Name: 2-[[(3R)-3-(benzyloxycarbonylamino)-4-bromo-butanoyl]amino]acetic acid ethyl ester Formula: C16H21BrN2O5 MolecularWeight: 401.25234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CC(CBr)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CNC(=O)C[C@H](CBr)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C16H21BrN2O5/c1-2-23-15(21)10-18-14(20)8-13(9-17)19-16(22)24-11-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3,(H,18,20)(H,19,22)/t13-/m1/s1