O1-tert-butyl O4-ethyl 2,3,6,7-tetrahydroazepine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-ethyl 2,3,6,7-tetrahydroazepine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-ethyl 2,3,6,7-tetrahydroazepine-1,4-dicarboxylate CAS Name: 2,3,6,7-tetrahydroazepine-1,4-dicarboxylic acid O1-tert-butyl ester O4-ethyl ester IUPAC Name: 1-O-tert-butyl 4-O-ethyl 2,3,6,7-tetrahydroazepine-1,4-dicarboxylate Traditional Name: 2,3,6,7-tetrahydroazepine-1,4-dicarboxylic acid O1-tert-butyl ester O4-ethyl ester Formula: C14H23NO4 MolecularWeight: 269.33672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CCCN(CC1)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CCCN(CC1)C(=O)OC(C)(C)C

InChI

InChI=1S/C14H23NO4/c1-5-18-12(16)11-7-6-9-15(10-8-11)13(17)19-14(2,3)4/h7H,5-6,8-10H2,1-4H3