O4-tert-butyl O1-methyl (2R,3S)-2-(2-oxidanylideneethyl)-3-(phenylmethoxycarbonylamino)butanedioate

Systemtic Name: O4-tert-butyl O1-methyl (2R,3S)-2-(2-oxidanylideneethyl)-3-(phenylmethoxycarbonylamino)butanedioate Openeye Name: O1-tert-butyl O4-methyl (2S,3R)-2-(benzyloxycarbonylamino)-3-(2-oxoethyl)butanedioate CAS Name: (2R,3S)-2-(2-oxoethyl)-3-(phenylmethoxycarbonylamino)butanedioic acid O4-tert-butyl ester O1-methyl ester IUPAC Name: 4-O-tert-butyl 1-O-methyl (2R,3S)-2-(2-oxoethyl)-3-(phenylmethoxycarbonylamino)butanedioate Traditional Name: (2S,3R)-2-(benzyloxycarbonylamino)-3-(2-ketoethyl)succinic acid O1-tert-butyl ester O4-methyl ester Formula: C19H25NO7 MolecularWeight: 379.4043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C(CC=O)C(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]([C@@H](CC=O)C(=O)OC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C19H25NO7/c1-19(2,3)27-17(23)15(14(10-11-21)16(22)25-4)20-18(24)26-12-13-8-6-5-7-9-13/h5-9,11,14-15H,10,12H2,1-4H3,(H,20,24)/t14-,15+/m1/s1