5-azoniaspiro[4.5]decan-3-yl 2-oxidanyl-2-thiophen-2-yl-propanoate bromide

Systemtic Name: 5-azoniaspiro[4.5]decan-3-yl 2-oxidanyl-2-thiophen-2-yl-propanoate bromide Openeye Name: 5-azoniaspiro[4.5]decan-3-yl 2-hydroxy-2-(2-thienyl)propanoate bromide CAS Name: 2-hydroxy-2-thiophen-2-ylpropanoic acid 5-azoniaspiro[4.5]decan-3-yl ester bromide IUPAC Name: 5-azoniaspiro[4.5]decan-3-yl 2-hydroxy-2-thiophen-2-ylpropanoate bromide Traditional Name: 2-hydroxy-2-(2-thienyl)propionic acid 5-azoniaspiro[4.5]decan-3-yl ester bromide Formula: C16H24BrNO3S MolecularWeight: 390.33566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)(C(=O)OC2CC[N+]3(C2)CCCCC3)O.[Br-]

Isomeric SMILES

CC(C1=CC=CS1)(C(=O)OC2CC[N+]3(C2)CCCCC3)O.[Br-]

InChI

InChI=1S/C16H24NO3S.BrH/c1-16(19,14-6-5-11-21-14)15(18)20-13-7-10-17(12-13)8-3-2-4-9-17;/h5-6,11,13,19H,2-4,7-10,12H2,1H3;1H/q+1;/p-1