phenyl 9-bromanyl-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonate

Systemtic Name: phenyl 9-bromanyl-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonate Openeye Name: phenyl 9-bromo-7-isopropylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonate CAS Name: 9-bromo-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester IUPAC Name: phenyl 9-bromo-7-propan-2-ylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonate Traditional Name: 9-bromo-7-isopropylsulfonyl-9-azaspiro[4.4]nonane-3-sulfonic acid phenyl ester Formula: C17H24BrNO5S2 MolecularWeight: 466.41016

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H24BrNO5S2/c1-13(2)25(20,21)16-11-17(19(18)12-16)9-8-15(10-17)26(22,23)24-14-6-4-3-5-7-14/h3-7,13,15-16H,8-12H2,1-2H3