4-nitro-N-[(1S,2S)-1-oxidanyl-1-phenyl-propan-2-yl]benzamide

Systemtic Name: 4-nitro-N-[(1S,2S)-1-oxidanyl-1-phenyl-propan-2-yl]benzamide Openeye Name: N-[(1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-4-nitro-benzamide CAS Name: N-[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-4-nitrobenzamide IUPAC Name: N-[(1S,2S)-1-hydroxy-1-phenylpropan-2-yl]-4-nitrobenzamide Traditional Name: N-[(1S,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-4-nitro-benzamide Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O4/c1-11(15(19)12-5-3-2-4-6-12)17-16(20)13-7-9-14(10-8-13)18(21)22/h2-11,15,19H,1H3,(H,17,20)/t11-,15+/m0/s1