phenyl 7,9-bis(propan-2-ylsulfonyl)-9-azaspiro[4.4]nonane-3-sulfonate

Systemtic Name: phenyl 7,9-bis(propan-2-ylsulfonyl)-9-azaspiro[4.4]nonane-3-sulfonate Openeye Name: phenyl 7,9-bis(isopropylsulfonyl)-9-azaspiro[4.4]nonane-3-sulfonate CAS Name: 7,9-bis(propan-2-ylsulfonyl)-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester IUPAC Name: phenyl 7,9-bis(propan-2-ylsulfonyl)-9-azaspiro[4.4]nonane-3-sulfonate Traditional Name: 7,9-bis(isopropylsulfonyl)-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester Formula: C20H31NO7S3 MolecularWeight: 493.65764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CC2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)S(=O)(=O)C(C)C

Isomeric SMILES

CC(C)S(=O)(=O)C1CC2(CCC(C2)S(=O)(=O)OC3=CC=CC=C3)N(C1)S(=O)(=O)C(C)C

InChI

InChI=1S/C20H31NO7S3/c1-15(2)29(22,23)19-13-20(21(14-19)30(24,25)16(3)4)11-10-18(12-20)31(26,27)28-17-8-6-5-7-9-17/h5-9,15-16,18-19H,10-14H2,1-4H3