1-(2-methylpropyl)-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4,5-trione

Systemtic Name: 1-(2-methylpropyl)-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4,5-trione Openeye Name: 1-isobutyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4,5-trione CAS Name: 1-(2-methylpropyl)-3-[[4-(4-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]imidazolidine-2,4,5-trione IUPAC Name: 1-(2-methylpropyl)-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4,5-trione Traditional Name: 1-isobutyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4,5-trione Formula: C17H25N5O3+2 MolecularWeight: 347.4121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C(=O)N(C1=O)C[NH+]2CCN(CC2)C3=CC=[NH+]C=C3

Isomeric SMILES

CC(C)CN1C(=O)C(=O)N(C1=O)C[NH+]2CCN(CC2)C3=CC=[NH+]C=C3

InChI

InChI=1S/C17H23N5O3/c1-13(2)11-21-15(23)16(24)22(17(21)25)12-19-7-9-20(10-8-19)14-3-5-18-6-4-14/h3-6,13H,7-12H2,1-2H3/p+2