8-methyl-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 8-methyl-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-methyl-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-methyl-2-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-methyl-2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-methyl-2-[(4-pyridin-1-ium-2-ylpiperazino)methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C18H28N6O2+2 MolecularWeight: 360.45392

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC2(CC1)C(=O)N(C(=O)N2)CN3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C[NH+]1CCC2(CC1)C(=O)N(C(=O)N2)CN3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C18H26N6O2/c1-21-8-5-18(6-9-21)16(25)24(17(26)20-18)14-22-10-12-23(13-11-22)15-4-2-3-7-19-15/h2-4,7H,5-6,8-14H2,1H3,(H,20,26)/p+2