2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione

Systemtic Name: 2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione Openeye Name: 2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione CAS Name: 2-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione IUPAC Name: 2-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione Traditional Name: 2-[(4-pyridin-1-ium-2-ylpiperazino)methyl]-2,4-diazaspiro[4.6]undecane-1,3-quinone Formula: C19H28N5O2+ MolecularWeight: 358.45792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2(CC1)C(=O)N(C(=O)N2)CN3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CCCC2(CC1)C(=O)N(C(=O)N2)CN3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C19H27N5O2/c25-17-19(8-4-1-2-5-9-19)21-18(26)24(17)15-22-11-13-23(14-12-22)16-7-3-6-10-20-16/h3,6-7,10H,1-2,4-5,8-9,11-15H2,(H,21,26)/p+1