8-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-8-azaspiro[4.4]nonane-7,9-dione

Systemtic Name: 8-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-8-azaspiro[4.4]nonane-7,9-dione Openeye Name: 8-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]-8-azaspiro[4.4]nonane-7,9-dione CAS Name: 8-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]-8-azaspiro[4.4]nonane-7,9-dione IUPAC Name: 8-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-8-azaspiro[4.4]nonane-7,9-dione Traditional Name: 8-[(4-tosylpiperazino)methyl]-8-azaspiro[4.4]nonane-7,9-quinone Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=O)CC4(C3=O)CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=O)CC4(C3=O)CCCC4

InChI

InChI=1S/C20H27N3O4S/c1-16-4-6-17(7-5-16)28(26,27)22-12-10-21(11-13-22)15-23-18(24)14-20(19(23)25)8-2-3-9-20/h4-7H,2-3,8-15H2,1H3