ethyl (2R)-8-phenyl-4-thia-1-azoniaspiro[4.5]decane-2-carboxylate

Systemtic Name: ethyl (2R)-8-phenyl-4-thia-1-azoniaspiro[4.5]decane-2-carboxylate Openeye Name: ethyl (2R)-8-phenyl-4-thia-1-azoniaspiro[4.5]decane-2-carboxylate CAS Name: (2R)-8-phenyl-4-thia-1-azoniaspiro[4.5]decane-2-carboxylic acid ethyl ester IUPAC Name: ethyl (2R)-8-phenyl-4-thia-1-azoniaspiro[4.5]decane-2-carboxylate Traditional Name: (2R)-8-phenyl-4-thia-1-azoniaspiro[4.5]decane-2-carboxylic acid ethyl ester Formula: C17H24NO2S+ MolecularWeight: 306.44296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC2([NH2+]1)CCC(CC2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]1CSC2([NH2+]1)CCC(CC2)C3=CC=CC=C3

InChI

InChI=1S/C17H23NO2S/c1-2-20-16(19)15-12-21-17(18-15)10-8-14(9-11-17)13-6-4-3-5-7-13/h3-7,14-15,18H,2,8-12H2,1H3/p+1/t14?,15-,17?/m0/s1