phenyl 9-chloranyl-3-(phenylmethyl)-9-azaspiro[4.4]nonane-7-sulfonate

Systemtic Name: phenyl 9-chloranyl-3-(phenylmethyl)-9-azaspiro[4.4]nonane-7-sulfonate Openeye Name: phenyl 3-benzyl-9-chloro-9-azaspiro[4.4]nonane-7-sulfonate CAS Name: 9-chloro-3-(phenylmethyl)-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester IUPAC Name: phenyl 3-benzyl-9-chloro-9-azaspiro[4.4]nonane-7-sulfonate Traditional Name: 3-benzyl-9-chloro-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester Formula: C21H24ClNO3S MolecularWeight: 405.93816

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CC1CC3=CC=CC=C3)CC(CN2Cl)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1CC2(CC1CC3=CC=CC=C3)CC(CN2Cl)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C21H24ClNO3S/c22-23-16-20(27(24,25)26-19-9-5-2-6-10-19)15-21(23)12-11-18(14-21)13-17-7-3-1-4-8-17/h1-10,18,20H,11-16H2