O2-tert-butyl O7-methyl 4-oxidanyl-4,5-dihydro-1H-azepine-2,7-dicarboxylate

Systemtic Name: O2-tert-butyl O7-methyl 4-oxidanyl-4,5-dihydro-1H-azepine-2,7-dicarboxylate Openeye Name: O2-tert-butyl O7-methyl 4-hydroxy-4,5-dihydro-1H-azepine-2,7-dicarboxylate CAS Name: 4-hydroxy-4,5-dihydro-1H-azepine-2,7-dicarboxylic acid O2-tert-butyl ester O7-methyl ester IUPAC Name: 2-O-tert-butyl 7-O-methyl 4-hydroxy-4,5-dihydro-1H-azepine-2,7-dicarboxylate Traditional Name: 4-hydroxy-4,5-dihydro-1H-azepine-2,7-dicarboxylic acid O2-tert-butyl ester O7-methyl ester Formula: C13H19NO5 MolecularWeight: 269.29366

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO5/c1-13(2,3)19-12(17)10-7-8(15)5-6-9(14-10)11(16)18-4/h6-8,14-15H,5H2,1-4H3