1-(4-nitrophenyl)-N-[(2S)-2-oxidanyl-3-phenoxy-propyl]methanimine oxide

Systemtic Name: 1-(4-nitrophenyl)-N-[(2S)-2-oxidanyl-3-phenoxy-propyl]methanimine oxide Openeye Name: N-[(2S)-2-hydroxy-3-phenoxy-propyl]-1-(4-nitrophenyl)methanimine oxide CAS Name: N-[(2S)-2-hydroxy-3-phenoxypropyl]-1-(4-nitrophenyl)methanimine oxide IUPAC Name: N-[(2S)-2-hydroxy-3-phenoxypropyl]-1-(4-nitrophenyl)methanimine oxide Traditional Name: N-[(2S)-2-hydroxy-3-phenoxy-propyl]-1-(4-nitrophenyl)methanimine oxide Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(C[N+](=CC2=CC=C(C=C2)[N+](=O)[O-])[O-])O

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O5/c19-15(12-23-16-4-2-1-3-5-16)11-17(20)10-13-6-8-14(9-7-13)18(21)22/h1-10,15,19H,11-12H2/b17-10-/t15-/m0/s1