ethyl (3aS,8aS)-4-morpholin-4-yl-1,2,3,3a,8,8a-hexahydroazulene-5-carboxylate

Systemtic Name: ethyl (3aS,8aS)-4-morpholin-4-yl-1,2,3,3a,8,8a-hexahydroazulene-5-carboxylate Openeye Name: ethyl (3aS,8aS)-4-morpholino-1,2,3,3a,8,8a-hexahydroazulene-5-carboxylate CAS Name: (3aS,8aS)-4-(4-morpholinyl)-1,2,3,3a,8,8a-hexahydroazulene-5-carboxylic acid ethyl ester IUPAC Name: ethyl (3aS,8aS)-4-morpholin-4-yl-1,2,3,3a,8,8a-hexahydroazulene-5-carboxylate Traditional Name: (3aS,8aS)-4-morpholino-1,2,3,3a,8,8a-hexahydroazulene-5-carboxylic acid ethyl ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2CCCC2CC=C1)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C([C@H]2CCC[C@H]2CC=C1)N3CCOCC3

InChI

InChI=1S/C17H25NO3/c1-2-21-17(19)15-8-4-6-13-5-3-7-14(13)16(15)18-9-11-20-12-10-18/h4,8,13-14H,2-3,5-7,9-12H2,1H3/t13-,14-/m0/s1