tert-butyl N-[(2S)-3-oxidanyl-4-oxidanylidene-4-(phenethylamino)-1-phenyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-3-oxidanyl-4-oxidanylidene-4-(phenethylamino)-1-phenyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-2-hydroxy-3-oxo-3-(phenethylamino)propyl]carbamate CAS Name: N-[(2S)-3-hydroxy-4-oxo-4-(phenethylamino)-1-phenylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-3-hydroxy-4-oxo-4-(phenethylamino)-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-hydroxy-3-keto-3-(phenethylamino)propyl]carbamic acid tert-butyl ester Formula: C23H30N2O4 MolecularWeight: 398.4953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(C(=O)NCCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(C(=O)NCCC2=CC=CC=C2)O

InChI

InChI=1S/C23H30N2O4/c1-23(2,3)29-22(28)25-19(16-18-12-8-5-9-13-18)20(26)21(27)24-15-14-17-10-6-4-7-11-17/h4-13,19-20,26H,14-16H2,1-3H3,(H,24,27)(H,25,28)/t19-,20?/m0/s1