(2-acetyloxy-1-phenyl-ethyl) 4-nitrobenzoate

Systemtic Name: (2-acetyloxy-1-phenyl-ethyl) 4-nitrobenzoate Openeye Name: (2-acetoxy-1-phenyl-ethyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-acetyloxy-1-phenylethyl) ester IUPAC Name: (2-acetyloxy-1-phenylethyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-acetoxy-1-phenyl-ethyl) ester Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO6/c1-12(19)23-11-16(13-5-3-2-4-6-13)24-17(20)14-7-9-15(10-8-14)18(21)22/h2-10,16H,11H2,1H3