(2S)-N-(2-bromanyl-4-nitro-phenyl)-2-(butylamino)-2-phenyl-ethanamide

Systemtic Name: (2S)-N-(2-bromanyl-4-nitro-phenyl)-2-(butylamino)-2-phenyl-ethanamide Openeye Name: (2S)-N-(2-bromo-4-nitro-phenyl)-2-(butylamino)-2-phenyl-acetamide CAS Name: (2S)-N-(2-bromo-4-nitrophenyl)-2-(butylamino)-2-phenylacetamide IUPAC Name: (2S)-N-(2-bromo-4-nitrophenyl)-2-(butylamino)-2-phenylacetamide Traditional Name: (2S)-N-(2-bromo-4-nitro-phenyl)-2-(butylamino)-2-phenyl-acetamide Formula: C18H20BrN3O3 MolecularWeight: 406.2737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCCCN[C@@H](C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C18H20BrN3O3/c1-2-3-11-20-17(13-7-5-4-6-8-13)18(23)21-16-10-9-14(22(24)25)12-15(16)19/h4-10,12,17,20H,2-3,11H2,1H3,(H,21,23)/t17-/m0/s1