(2-azanyl-2-oxidanylidene-ethyl) 3-(4-bromophenyl)-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 3-(4-bromophenyl)-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (2-amino-2-oxo-ethyl) 2-(benzyloxycarbonylamino)-3-(4-bromophenyl)propanoate CAS Name: 3-(4-bromophenyl)-2-(phenylmethoxycarbonylamino)propanoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 3-(4-bromophenyl)-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-(4-bromophenyl)propionic acid (2-amino-2-keto-ethyl) ester Formula: C19H19BrN2O5 MolecularWeight: 435.26856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=C(C=C2)Br)C(=O)OCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC2=CC=C(C=C2)Br)C(=O)OCC(=O)N

InChI

InChI=1S/C19H19BrN2O5/c20-15-8-6-13(7-9-15)10-16(18(24)26-12-17(21)23)22-19(25)27-11-14-4-2-1-3-5-14/h1-9,16H,10-12H2,(H2,21,23)(H,22,25)