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

Systemtic Name: methyl 2-(2-nitrophenyl)-5-oxidanylidene-pentanoate Openeye Name: methyl 2-(2-nitrophenyl)-5-oxo-pentanoate CAS Name: 2-(2-nitrophenyl)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 2-(2-nitrophenyl)-5-oxopentanoate Traditional Name: 5-keto-2-(2-nitrophenyl)valeric acid methyl ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO5/c1-18-12(15)10(6-4-8-14)9-5-2-3-7-11(9)13(16)17/h2-3,5,7-8,10H,4,6H2,1H3