phenyl 9-chloranyl-3-oxidanyl-9-azaspiro[4.4]nonane-7-sulfonate

Systemtic Name: phenyl 9-chloranyl-3-oxidanyl-9-azaspiro[4.4]nonane-7-sulfonate Openeye Name: phenyl 9-chloro-3-hydroxy-9-azaspiro[4.4]nonane-7-sulfonate CAS Name: 9-chloro-3-hydroxy-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester IUPAC Name: phenyl 9-chloro-3-hydroxy-9-azaspiro[4.4]nonane-7-sulfonate Traditional Name: 9-chloro-3-hydroxy-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester Formula: C14H18ClNO4S MolecularWeight: 331.81502

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1O)CC(CN2Cl)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

C1CC2(CC1O)CC(CN2Cl)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C14H18ClNO4S/c15-16-10-13(9-14(16)7-6-11(17)8-14)21(18,19)20-12-4-2-1-3-5-12/h1-5,11,13,17H,6-10H2