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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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