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

Systemtic Name: phenyl 3-bromanyl-9-chloranyl-9-azaspiro[4.4]nonane-7-sulfonate Openeye Name: phenyl 3-bromo-9-chloro-9-azaspiro[4.4]nonane-7-sulfonate CAS Name: 3-bromo-9-chloro-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester IUPAC Name: phenyl 3-bromo-9-chloro-9-azaspiro[4.4]nonane-7-sulfonate Traditional Name: 3-bromo-9-chloro-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester Formula: C14H17BrClNO3S MolecularWeight: 394.71168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1Br)CC(CN2Cl)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

C1CC2(CC1Br)CC(CN2Cl)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C14H17BrClNO3S/c15-11-6-7-14(8-11)9-13(10-17(14)16)21(18,19)20-12-4-2-1-3-5-12/h1-5,11,13H,6-10H2