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

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

CON1CC(CC12CCC(C2)CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CON1CC(CC12CCC(C2)CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

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