8-[3-oxidanyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-8-azaspiro[4.5]decane-7,9-dione

Systemtic Name: 8-[3-oxidanyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-8-azaspiro[4.5]decane-7,9-dione Openeye Name: 8-[3-hydroxy-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-8-azaspiro[4.5]decane-7,9-dione CAS Name: 8-[3-hydroxy-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-8-azaspiro[4.5]decane-7,9-dione IUPAC Name: 8-[3-hydroxy-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-8-azaspiro[4.5]decane-7,9-dione Traditional Name: 8-[3-hydroxy-4-[4-(2-pyrimidyl)piperazino]butyl]-8-azaspiro[4.5]decane-7,9-quinone Formula: C21H31N5O3 MolecularWeight: 401.50254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC(=O)N(C(=O)C2)CCC(CN3CCN(CC3)C4=NC=CC=N4)O

Isomeric SMILES

C1CCC2(C1)CC(=O)N(C(=O)C2)CCC(CN3CCN(CC3)C4=NC=CC=N4)O

InChI

InChI=1S/C21H31N5O3/c27-17(16-24-10-12-25(13-11-24)20-22-7-3-8-23-20)4-9-26-18(28)14-21(15-19(26)29)5-1-2-6-21/h3,7-8,17,27H,1-2,4-6,9-16H2