1,5-diethyl-3,7-bis-(4-methylphenyl)sulfonyl-3,7-diazabicyclo[3.3.1]nonan-9-one

Systemtic Name: 1,5-diethyl-3,7-bis-(4-methylphenyl)sulfonyl-3,7-diazabicyclo[3.3.1]nonan-9-one Openeye Name: 1,5-diethyl-3,7-bis(p-tolylsulfonyl)-3,7-diazabicyclo[3.3.1]nonan-9-one CAS Name: 1,5-diethyl-3,7-bis-(4-methylphenyl)sulfonyl-3,7-diazabicyclo[3.3.1]nonan-9-one IUPAC Name: 1,5-diethyl-3,7-bis-(4-methylphenyl)sulfonyl-3,7-diazabicyclo[3.3.1]nonan-9-one Traditional Name: 1,5-diethyl-3,7-ditosyl-3,7-diazabicyclo[3.3.1]nonan-9-one Formula: C25H32N2O5S2 MolecularWeight: 504.66198

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CN(CC(C1=O)(CN(C2)S(=O)(=O)C3=CC=C(C=C3)C)CC)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC12CN(CC(C1=O)(CN(C2)S(=O)(=O)C3=CC=C(C=C3)C)CC)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H32N2O5S2/c1-5-24-15-26(33(29,30)21-11-7-19(3)8-12-21)17-25(6-2,23(24)28)18-27(16-24)34(31,32)22-13-9-20(4)10-14-22/h7-14H,5-6,15-18H2,1-4H3