[(1S)-2-[(4,5-dimethoxy-2-nitro-phenyl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(4,5-dimethoxy-2-nitro-phenyl)carbonylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(4,5-dimethoxy-2-nitro-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(4,5-dimethoxy-2-nitrophenyl)-oxomethyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(4,5-dimethoxy-2-nitrobenzoyl)amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(4,5-dimethoxy-2-nitro-benzoyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C19H24N3O5+ MolecularWeight: 374.41096

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OC)OC)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OC)OC)C2=CC=CC=C2

InChI

InChI=1S/C19H23N3O5/c1-21(2)16(13-8-6-5-7-9-13)12-20-19(23)14-10-17(26-3)18(27-4)11-15(14)22(24)25/h5-11,16H,12H2,1-4H3,(H,20,23)/p+1/t16-/m1/s1