O7-tert-butyl O2-methyl 5-oxidanylidene-1,4-dihydroazepine-2,7-dicarboxylate

Systemtic Name: O7-tert-butyl O2-methyl 5-oxidanylidene-1,4-dihydroazepine-2,7-dicarboxylate Openeye Name: O7-tert-butyl O2-methyl 5-oxo-1,4-dihydroazepine-2,7-dicarboxylate CAS Name: 5-oxo-1,4-dihydroazepine-2,7-dicarboxylic acid O7-tert-butyl ester O2-methyl ester IUPAC Name: 7-O-tert-butyl 2-O-methyl 5-oxo-1,4-dihydroazepine-2,7-dicarboxylate Traditional Name: 5-keto-1,4-dihydroazepine-2,7-dicarboxylic acid O7-tert-butyl ester O2-methyl ester Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=O)CC=C(N1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=O)CC=C(N1)C(=O)OC

InChI

InChI=1S/C13H17NO5/c1-13(2,3)19-12(17)10-7-8(15)5-6-9(14-10)11(16)18-4/h6-7,14H,5H2,1-4H3