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

Systemtic Name: phenyl 3-(phenylmethyl)-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonate Openeye Name: phenyl 3-benzyl-7-isopropylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonate CAS Name: 3-(phenylmethyl)-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester IUPAC Name: phenyl 3-benzyl-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonate Traditional Name: 3-benzyl-7-isopropylsulfonyl-9-azaspiro[4.4]nonane-9-sulfonic acid phenyl ester Formula: C24H31NO5S2 MolecularWeight: 477.63664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CC2(CCC(C2)CC3=CC=CC=C3)N(C1)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CC(C)S(=O)(=O)C1CC2(CCC(C2)CC3=CC=CC=C3)N(C1)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C24H31NO5S2/c1-19(2)31(26,27)23-17-24(14-13-21(16-24)15-20-9-5-3-6-10-20)25(18-23)32(28,29)30-22-11-7-4-8-12-22/h3-12,19,21,23H,13-18H2,1-2H3