methyl 2-(2-nitrophenyl)-5-oxidanylidene-hexanoate

Systemtic Name: methyl 2-(2-nitrophenyl)-5-oxidanylidene-hexanoate Openeye Name: methyl 2-(2-nitrophenyl)-5-oxo-hexanoate CAS Name: 2-(2-nitrophenyl)-5-oxohexanoic acid methyl ester IUPAC Name: methyl 2-(2-nitrophenyl)-5-oxohexanoate Traditional Name: 5-keto-2-(2-nitrophenyl)hexanoic acid methyl ester Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO5/c1-9(15)7-8-11(13(16)19-2)10-5-3-4-6-12(10)14(17)18/h3-6,11H,7-8H2,1-2H3