tert-butyl (4S)-2,2-bis(bromanyl)-3-oxidanylidene-5-phenyl-4-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: tert-butyl (4S)-2,2-bis(bromanyl)-3-oxidanylidene-5-phenyl-4-(phenylmethoxycarbonylamino)pentanoate Openeye Name: tert-butyl (4S)-4-(benzyloxycarbonylamino)-2,2-dibromo-3-oxo-5-phenyl-pentanoate CAS Name: (4S)-2,2-dibromo-3-oxo-5-phenyl-4-(phenylmethoxycarbonylamino)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-2,2-dibromo-3-oxo-5-phenyl-4-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (4S)-4-(benzyloxycarbonylamino)-2,2-dibromo-3-keto-5-phenyl-valeric acid tert-butyl ester Formula: C23H25Br2NO5 MolecularWeight: 555.2563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(=O)C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)(Br)Br

Isomeric SMILES

CC(C)(C)OC(=O)C(C(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)(Br)Br

InChI

InChI=1S/C23H25Br2NO5/c1-22(2,3)31-20(28)23(24,25)19(27)18(14-16-10-6-4-7-11-16)26-21(29)30-15-17-12-8-5-9-13-17/h4-13,18H,14-15H2,1-3H3,(H,26,29)/t18-/m0/s1