ethyl 4-morpholin-4-yl-2,3,6,7-tetrahydroazepine-1-carboxylate

Systemtic Name: ethyl 4-morpholin-4-yl-2,3,6,7-tetrahydroazepine-1-carboxylate Openeye Name: ethyl 4-morpholino-2,3,6,7-tetrahydroazepine-1-carboxylate CAS Name: 4-(4-morpholinyl)-2,3,6,7-tetrahydroazepine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-morpholin-4-yl-2,3,6,7-tetrahydroazepine-1-carboxylate Traditional Name: 4-morpholino-2,3,6,7-tetrahydroazepine-1-carboxylic acid ethyl ester Formula: C13H22N2O3 MolecularWeight: 254.32538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC=C(CC1)N2CCOCC2

Isomeric SMILES

CCOC(=O)N1CCC=C(CC1)N2CCOCC2

InChI

InChI=1S/C13H22N2O3/c1-2-18-13(16)15-6-3-4-12(5-7-15)14-8-10-17-11-9-14/h4H,2-3,5-11H2,1H3