(1-oxidanylidene-1-phenyl-butan-2-yl) 4-nitrobenzoate

Systemtic Name: (1-oxidanylidene-1-phenyl-butan-2-yl) 4-nitrobenzoate Openeye Name: 1-benzoylpropyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (1-oxo-1-phenylbutan-2-yl) ester IUPAC Name: (1-oxo-1-phenylbutan-2-yl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 1-benzoylpropyl ester Formula: C17H15NO5 MolecularWeight: 313.3047

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO5/c1-2-15(16(19)12-6-4-3-5-7-12)23-17(20)13-8-10-14(11-9-13)18(21)22/h3-11,15H,2H2,1H3