(5R)-1-cyclohexyl-5-(2-piperidin-1-ium-1-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: (5R)-1-cyclohexyl-5-(2-piperidin-1-ium-1-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione Openeye Name: (5R)-1-cyclohexyl-5-(2-piperidin-1-ium-1-ylethyliminomethyl)hexahydropyrimidine-2,4,6-trione CAS Name: (5R)-1-cyclohexyl-5-[2-(1-piperidin-1-iumyl)ethyliminomethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: (5R)-1-cyclohexyl-5-(2-piperidin-1-ium-1-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: (5R)-1-cyclohexyl-5-(2-piperidin-1-ium-1-ylethyliminomethyl)barbituric acid Formula: C18H29N4O3+ MolecularWeight: 349.44786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(C(=O)NC2=O)C=NCC[NH+]3CCCCC3

Isomeric SMILES

C1CCC(CC1)N2C(=O)[C@@H](C(=O)NC2=O)C=NCC[NH+]3CCCCC3

InChI

InChI=1S/C18H28N4O3/c23-16-15(13-19-9-12-21-10-5-2-6-11-21)17(24)22(18(25)20-16)14-7-3-1-4-8-14/h13-15H,1-12H2,(H,20,23,25)/p+1/t15-/m1/s1