phenyl 10-(phenylmethyl)-3-propan-2-ylsulfonyl-10-azaspiro[4.5]decane-6-sulfonate

Systemtic Name: phenyl 10-(phenylmethyl)-3-propan-2-ylsulfonyl-10-azaspiro[4.5]decane-6-sulfonate Openeye Name: phenyl 10-benzyl-3-isopropylsulfonyl-10-azaspiro[4.5]decane-6-sulfonate CAS Name: 10-(phenylmethyl)-3-propan-2-ylsulfonyl-10-azaspiro[4.5]decane-6-sulfonic acid phenyl ester IUPAC Name: phenyl 10-benzyl-3-propan-2-ylsulfonyl-10-azaspiro[4.5]decane-6-sulfonate Traditional Name: 10-benzyl-3-isopropylsulfonyl-10-azaspiro[4.5]decane-6-sulfonic acid phenyl ester Formula: C25H33NO5S2 MolecularWeight: 491.66322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CCC2(C1)C(CCCN2CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CC(C)S(=O)(=O)C1CCC2(C1)C(CCCN2CC3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C25H33NO5S2/c1-20(2)32(27,28)23-15-16-25(18-23)24(33(29,30)31-22-12-7-4-8-13-22)14-9-17-26(25)19-21-10-5-3-6-11-21/h3-8,10-13,20,23-24H,9,14-19H2,1-2H3