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

Systemtic Name: O1-ethyl O5-methyl 4-ethanoyl-3-(2-nitrophenyl)-2-oxidanylidene-pentanedioate Openeye Name: O1-ethyl O5-methyl 4-acetyl-3-(2-nitrophenyl)-2-oxo-pentanedioate CAS Name: 4-acetyl-3-(2-nitrophenyl)-2-oxopentanedioic acid O1-ethyl ester O5-methyl ester IUPAC Name: 1-O-ethyl 5-O-methyl 4-acetyl-3-(2-nitrophenyl)-2-oxopentanedioate Traditional Name: 4-acetyl-2-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(=O)C(C1=CC=CC=C1[N+](=O)[O-])C(C(=O)C)C(=O)OC

Isomeric SMILES

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

InChI

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