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

Systemtic Name: phenyl 3-methoxy-9-(phenylmethyl)-9-azaspiro[4.4]nonane-7-sulfonate Openeye Name: phenyl 9-benzyl-3-methoxy-9-azaspiro[4.4]nonane-7-sulfonate CAS Name: 3-methoxy-9-(phenylmethyl)-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester IUPAC Name: phenyl 9-benzyl-3-methoxy-9-azaspiro[4.4]nonane-7-sulfonate Traditional Name: 9-benzyl-3-methoxy-9-azaspiro[4.4]nonane-7-sulfonic acid phenyl ester Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC2(C1)CC(CN2CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

COC1CCC2(C1)CC(CN2CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C22H27NO4S/c1-26-20-12-13-22(14-20)15-21(17-23(22)16-18-8-4-2-5-9-18)28(24,25)27-19-10-6-3-7-11-19/h2-11,20-21H,12-17H2,1H3