O1-ethyl O5-methyl 2-ethanoyl-3-(2-nitrophenyl)-4-oxidanylidene-pentanedioate

Systemtic Name: O1-ethyl O5-methyl 2-ethanoyl-3-(2-nitrophenyl)-4-oxidanylidene-pentanedioate Openeye Name: O1-ethyl O5-methyl 2-acetyl-3-(2-nitrophenyl)-4-oxo-pentanedioate CAS Name: 2-acetyl-3-(2-nitrophenyl)-4-oxopentanedioic acid O1-ethyl ester O5-methyl ester IUPAC Name: 1-O-ethyl 5-O-methyl 2-acetyl-3-(2-nitrophenyl)-4-oxopentanedioate Traditional Name: 2-acetyl-4-keto-3-(2-nitrophenyl)glutaric acid O1-ethyl ester O5-methyl ester Formula: C16H17NO8 MolecularWeight: 351.30808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO8/c1-4-25-15(20)12(9(2)18)13(14(19)16(21)24-3)10-7-5-6-8-11(10)17(22)23/h5-8,12-13H,4H2,1-3H3