propan-2-yl (1S)-1-(2-cyanoethyl)-2-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: propan-2-yl (1S)-1-(2-cyanoethyl)-2-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: isopropyl (1S)-1-(2-cyanoethyl)-2-oxo-cyclopentanecarboxylate CAS Name: (1S)-1-(2-cyanoethyl)-2-oxo-1-cyclopentanecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (1S)-1-(2-cyanoethyl)-2-oxocyclopentane-1-carboxylate Traditional Name: (1S)-1-(2-cyanoethyl)-2-keto-cyclopentanecarboxylic acid isopropyl ester Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1(CCCC1=O)CCC#N

Isomeric SMILES

CC(C)OC(=O)[C@@]1(CCCC1=O)CCC#N

InChI

InChI=1S/C12H17NO3/c1-9(2)16-11(15)12(7-4-8-13)6-3-5-10(12)14/h9H,3-7H2,1-2H3/t12-/m0/s1