O1-tert-butyl O6-methyl 2-(2-nitrophenyl)-3-oxidanylidene-hexanedioate

Systemtic Name: O1-tert-butyl O6-methyl 2-(2-nitrophenyl)-3-oxidanylidene-hexanedioate Openeye Name: O1-tert-butyl O6-methyl 2-(2-nitrophenyl)-3-oxo-hexanedioate CAS Name: 2-(2-nitrophenyl)-3-oxohexanedioic acid O1-tert-butyl ester O6-methyl ester IUPAC Name: 1-O-tert-butyl 6-O-methyl 2-(2-nitrophenyl)-3-oxohexanedioate Traditional Name: 3-keto-2-(2-nitrophenyl)adipic acid O1-tert-butyl ester O6-methyl ester Formula: C17H21NO7 MolecularWeight: 351.35114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO7/c1-17(2,3)25-16(21)15(13(19)9-10-14(20)24-4)11-7-5-6-8-12(11)18(22)23/h5-8,15H,9-10H2,1-4H3