tert-butyl N-[(2S)-3-(4-dimethylaminophenyl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-3-(4-dimethylaminophenyl)-1-(methylamino)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(4-dimethylaminophenyl)methyl]-2-(methylamino)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-3-(4-dimethylaminophenyl)-1-(methylamino)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-3-(4-dimethylaminophenyl)-1-(methylamino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-1-[4-(dimethylamino)benzyl]-2-keto-2-(methylamino)ethyl]carbamic acid tert-butyl ester Formula: C17H27N3O3 MolecularWeight: 321.41458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)N(C)C)C(=O)NC

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O3/c1-17(2,3)23-16(22)19-14(15(21)18-4)11-12-7-9-13(10-8-12)20(5)6/h7-10,14H,11H2,1-6H3,(H,18,21)(H,19,22)/t14-/m0/s1