[(1S)-2-[(2S)-oxiran-2-yl]-1-phenyl-ethyl] 4-nitrobenzoate

Systemtic Name: [(1S)-2-[(2S)-oxiran-2-yl]-1-phenyl-ethyl] 4-nitrobenzoate Openeye Name: [(1S)-2-[(2S)-oxiran-2-yl]-1-phenyl-ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1S)-2-[(2S)-2-oxiranyl]-1-phenylethyl] ester IUPAC Name: [(1S)-2-[(2S)-oxiran-2-yl]-1-phenylethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1S)-2-[(2S)-oxiran-2-yl]-1-phenyl-ethyl] ester Formula: C17H15NO5 MolecularWeight: 313.3047

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)CC(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1[C@@H](O1)C[C@@H](C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO5/c19-17(13-6-8-14(9-7-13)18(20)21)23-16(10-15-11-22-15)12-4-2-1-3-5-12/h1-9,15-16H,10-11H2/t15-,16-/m0/s1