O1-tert-butyl O7-methyl 2,3,4,5-tetrahydroazepine-1,7-dicarboxylate

Systemtic Name: O1-tert-butyl O7-methyl 2,3,4,5-tetrahydroazepine-1,7-dicarboxylate Openeye Name: O1-tert-butyl O7-methyl 2,3,4,5-tetrahydroazepine-1,7-dicarboxylate CAS Name: 2,3,4,5-tetrahydroazepine-1,7-dicarboxylic acid O1-tert-butyl ester O7-methyl ester IUPAC Name: 1-O-tert-butyl 7-O-methyl 2,3,4,5-tetrahydroazepine-1,7-dicarboxylate Traditional Name: 2,3,4,5-tetrahydroazepine-1,7-dicarboxylic acid O1-tert-butyl ester O7-methyl ester Formula: C13H21NO4 MolecularWeight: 255.31014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC=C1C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCC=C1C(=O)OC

InChI

InChI=1S/C13H21NO4/c1-13(2,3)18-12(16)14-9-7-5-6-8-10(14)11(15)17-4/h8H,5-7,9H2,1-4H3