(2S)-N-(2-bromanyl-4-nitro-phenyl)-2-[[(2S)-1-methoxypropan-2-yl]amino]-2-phenyl-ethanamide

Systemtic Name: (2S)-N-(2-bromanyl-4-nitro-phenyl)-2-[[(2S)-1-methoxypropan-2-yl]amino]-2-phenyl-ethanamide Openeye Name: (2S)-N-(2-bromo-4-nitro-phenyl)-2-[[(1S)-2-methoxy-1-methyl-ethyl]amino]-2-phenyl-acetamide CAS Name: (2S)-N-(2-bromo-4-nitrophenyl)-2-[[(2S)-1-methoxypropan-2-yl]amino]-2-phenylacetamide IUPAC Name: (2S)-N-(2-bromo-4-nitrophenyl)-2-[[(2S)-1-methoxypropan-2-yl]amino]-2-phenylacetamide Traditional Name: (2S)-N-(2-bromo-4-nitro-phenyl)-2-[[(1S)-2-methoxy-1-methyl-ethyl]amino]-2-phenyl-acetamide Formula: C18H20BrN3O4 MolecularWeight: 422.2731

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrN3O4/c1-12(11-26-2)20-17(13-6-4-3-5-7-13)18(23)21-16-9-8-14(22(24)25)10-15(16)19/h3-10,12,17,20H,11H2,1-2H3,(H,21,23)/t12-,17-/m0/s1