8-[(4-pyridin-4-ylcarbonylpiperazin-1-ium-1-yl)methyl]-8-azaspiro[4.4]nonane-7,9-dione

Systemtic Name: 8-[(4-pyridin-4-ylcarbonylpiperazin-1-ium-1-yl)methyl]-8-azaspiro[4.4]nonane-7,9-dione Openeye Name: 8-[[4-(pyridine-4-carbonyl)piperazin-1-ium-1-yl]methyl]-8-azaspiro[4.4]nonane-7,9-dione CAS Name: 8-[[4-[oxo(pyridin-4-yl)methyl]-1-piperazin-1-iumyl]methyl]-8-azaspiro[4.4]nonane-7,9-dione IUPAC Name: 8-[[4-(pyridine-4-carbonyl)piperazin-1-ium-1-yl]methyl]-8-azaspiro[4.4]nonane-7,9-dione Traditional Name: 8-[(4-isonicotinoylpiperazin-1-ium-1-yl)methyl]-8-azaspiro[4.4]nonane-7,9-quinone Formula: C19H25N4O3+ MolecularWeight: 357.4268

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC(=O)N(C2=O)C[NH+]3CCN(CC3)C(=O)C4=CC=NC=C4

Isomeric SMILES

C1CCC2(C1)CC(=O)N(C2=O)C[NH+]3CCN(CC3)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C19H24N4O3/c24-16-13-19(5-1-2-6-19)18(26)23(16)14-21-9-11-22(12-10-21)17(25)15-3-7-20-8-4-15/h3-4,7-8H,1-2,5-6,9-14H2/p+1