(5R)-5-methyl-3-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]-5-phenethyl-imidazolidine-2,4-dione

Systemtic Name: (5R)-5-methyl-3-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]-5-phenethyl-imidazolidine-2,4-dione Openeye Name: (5R)-5-methyl-3-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]-5-phenethyl-imidazolidine-2,4-dione CAS Name: (5R)-5-methyl-3-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]-5-phenethylimidazolidine-2,4-dione IUPAC Name: (5R)-5-methyl-3-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]-5-phenethylimidazolidine-2,4-dione Traditional Name: (5R)-3-[2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]-5-methyl-5-phenethyl-hydantoin Formula: C23H28N5O3+ MolecularWeight: 422.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)CC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)CCC4=CC=CC=C4

Isomeric SMILES

C[C@]1(C(=O)N(C(=O)N1)CC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O3/c1-23(11-10-18-7-3-2-4-8-18)21(30)28(22(31)25-23)17-20(29)27-15-13-26(14-16-27)19-9-5-6-12-24-19/h2-9,12H,10-11,13-17H2,1H3,(H,25,31)/p+1/t23-/m1/s1