5-azoniaspiro[4.5]decan-3-yl 2-butyl-2-oxidanyl-hexanoate

Systemtic Name: 5-azoniaspiro[4.5]decan-3-yl 2-butyl-2-oxidanyl-hexanoate Openeye Name: 5-azoniaspiro[4.5]decan-3-yl 2-butyl-2-hydroxy-hexanoate CAS Name: 2-butyl-2-hydroxyhexanoic acid 5-azoniaspiro[4.5]decan-3-yl ester IUPAC Name: 5-azoniaspiro[4.5]decan-3-yl 2-butyl-2-hydroxyhexanoate Traditional Name: 2-butyl-2-hydroxy-hexanoic acid 5-azoniaspiro[4.5]decan-3-yl ester Formula: C19H36NO3+ MolecularWeight: 326.49404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCCC)(C(=O)OC1CC[N+]2(C1)CCCCC2)O

Isomeric SMILES

CCCCC(CCCC)(C(=O)OC1CC[N+]2(C1)CCCCC2)O

InChI

InChI=1S/C19H36NO3/c1-3-5-11-19(22,12-6-4-2)18(21)23-17-10-15-20(16-17)13-8-7-9-14-20/h17,22H,3-16H2,1-2H3/q+1