tert-butyl N-[(2S)-1-[(3-chlorophenyl)amino]hexan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[(3-chlorophenyl)amino]hexan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(3-chloroanilino)methyl]pentyl]carbamate CAS Name: N-[(2S)-1-(3-chloroanilino)hexan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(3-chloroanilino)hexan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(3-chloroanilino)methyl]pentyl]carbamic acid tert-butyl ester Formula: C17H27ClN2O2 MolecularWeight: 326.86148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CNC1=CC(=CC=C1)Cl)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC[C@@H](CNC1=CC(=CC=C1)Cl)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H27ClN2O2/c1-5-6-9-15(20-16(21)22-17(2,3)4)12-19-14-10-7-8-13(18)11-14/h7-8,10-11,15,19H,5-6,9,12H2,1-4H3,(H,20,21)/t15-/m0/s1