[(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-[(4-chlorophenyl)methoxy]benzoate

Systemtic Name: [(2S)-1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-[(4-chlorophenyl)methoxy]benzoate Openeye Name: [(1S)-2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 2-[(4-chlorophenyl)methoxy]benzoate CAS Name: 2-[(4-chlorophenyl)methoxy]benzoic acid [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(tert-butylamino)-1-oxopropan-2-yl] 2-[(4-chlorophenyl)methoxy]benzoate Traditional Name: 2-(4-chlorobenzyl)oxybenzoic acid [(1S)-2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H24ClNO4 MolecularWeight: 389.87256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)C1=CC=CC=C1OCC2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@@H](C(=O)NC(C)(C)C)OC(=O)C1=CC=CC=C1OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClNO4/c1-14(19(24)23-21(2,3)4)27-20(25)17-7-5-6-8-18(17)26-13-15-9-11-16(22)12-10-15/h5-12,14H,13H2,1-4H3,(H,23,24)/t14-/m0/s1