(1-cyanoindolizin-2-yl)methyl 1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)cyclopentane-1-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)cyclopentane-1-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 1-(2-morpholino-2-oxo-ethyl)cyclopentanecarboxylate CAS Name: 1-[2-(4-morpholinyl)-2-oxoethyl]-1-cyclopentanecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 1-(2-morpholin-4-yl-2-oxoethyl)cyclopentane-1-carboxylate Traditional Name: 1-(2-keto-2-morpholino-ethyl)cyclopentanecarboxylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CC(=O)N2CCOCC2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

C1CCC(C1)(CC(=O)N2CCOCC2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C22H25N3O4/c23-14-18-17(15-25-8-4-1-5-19(18)25)16-29-21(27)22(6-2-3-7-22)13-20(26)24-9-11-28-12-10-24/h1,4-5,8,15H,2-3,6-7,9-13,16H2