(4-ethanoylphenyl)methyl 3-nitrobenzoate

Systemtic Name: (4-ethanoylphenyl)methyl 3-nitrobenzoate Openeye Name: (4-acetylphenyl)methyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (4-acetylphenyl)methyl ester IUPAC Name: (4-acetylphenyl)methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (4-acetylbenzyl) ester Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO5/c1-11(18)13-7-5-12(6-8-13)10-22-16(19)14-3-2-4-15(9-14)17(20)21/h2-9H,10H2,1H3