8-thia-5-azoniaspiro[4.5]decan-3-yl 2-oxidanyl-2-phenyl-propanoate

Systemtic Name: 8-thia-5-azoniaspiro[4.5]decan-3-yl 2-oxidanyl-2-phenyl-propanoate Openeye Name: 8-thia-5-azoniaspiro[4.5]decan-3-yl 2-hydroxy-2-phenyl-propanoate CAS Name: 2-hydroxy-2-phenylpropanoic acid 8-thia-5-azoniaspiro[4.5]decan-3-yl ester IUPAC Name: 8-thia-5-azoniaspiro[4.5]decan-3-yl 2-hydroxy-2-phenylpropanoate Traditional Name: 2-hydroxy-2-phenyl-propionic acid 8-thia-5-azoniaspiro[4.5]decan-3-yl ester Formula: C17H24NO3S+ MolecularWeight: 322.44236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)(C(=O)OC2CC[N+]3(C2)CCSCC3)O

Isomeric SMILES

CC(C1=CC=CC=C1)(C(=O)OC2CC[N+]3(C2)CCSCC3)O

InChI

InChI=1S/C17H24NO3S/c1-17(20,14-5-3-2-4-6-14)16(19)21-15-7-8-18(13-15)9-11-22-12-10-18/h2-6,15,20H,7-13H2,1H3/q+1