methyl 2-[(2S)-2-nitro-2-phenyl-ethanoyl]benzoate

Systemtic Name: methyl 2-[(2S)-2-nitro-2-phenyl-ethanoyl]benzoate Openeye Name: methyl 2-[(2S)-2-nitro-2-phenyl-acetyl]benzoate CAS Name: 2-[(2S)-2-nitro-1-oxo-2-phenylethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(2S)-2-nitro-2-phenylacetyl]benzoate Traditional Name: 2-[(2S)-2-nitro-2-phenyl-acetyl]benzoic acid methyl ester Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)C(C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)[C@H](C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO5/c1-22-16(19)13-10-6-5-9-12(13)15(18)14(17(20)21)11-7-3-2-4-8-11/h2-10,14H,1H3/t14-/m0/s1