2-[(9S)-7-(2-oxidanylideneethyl)-6,10-dioxaspiro[4.5]decan-9-yl]ethanenitrile

Systemtic Name: 2-[(9S)-7-(2-oxidanylideneethyl)-6,10-dioxaspiro[4.5]decan-9-yl]ethanenitrile Openeye Name: 2-[(9S)-7-(2-oxoethyl)-6,10-dioxaspiro[4.5]decan-9-yl]acetonitrile CAS Name: 2-[(9S)-7-(2-oxoethyl)-6,10-dioxaspiro[4.5]decan-9-yl]acetonitrile IUPAC Name: 2-[(9S)-7-(2-oxoethyl)-6,10-dioxaspiro[4.5]decan-9-yl]acetonitrile Traditional Name: 2-[(9S)-7-(2-ketoethyl)-6,10-dioxaspiro[4.5]decan-9-yl]acetonitrile Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC(CC(O2)CC#N)CC=O

Isomeric SMILES

C1CCC2(C1)O[C@H](CC(O2)CC=O)CC#N

InChI

InChI=1S/C12H17NO3/c13-7-3-10-9-11(4-8-14)16-12(15-10)5-1-2-6-12/h8,10-11H,1-6,9H2/t10-,11?/m0/s1