(1-oxidanylidene-1-phenyl-propan-2-yl) 3-nitrobenzoate

Systemtic Name: (1-oxidanylidene-1-phenyl-propan-2-yl) 3-nitrobenzoate Openeye Name: (1-methyl-2-oxo-2-phenyl-ethyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (1-oxo-1-phenylpropan-2-yl) ester IUPAC Name: (1-oxo-1-phenylpropan-2-yl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (2-keto-1-methyl-2-phenyl-ethyl) ester Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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