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

Systemtic Name: (5R)-5-methyl-3-[2-oxidanylidene-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethyl]-5-phenethyl-imidazolidine-2,4-dione Openeye Name: (5R)-5-methyl-3-[2-oxo-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethyl]-5-phenethyl-imidazolidine-2,4-dione CAS Name: (5R)-5-methyl-3-[2-oxo-2-[4-(4-pyridin-1-iumyl)-1-piperazinyl]ethyl]-5-phenethylimidazolidine-2,4-dione IUPAC Name: (5R)-5-methyl-3-[2-oxo-2-(4-pyridin-1-ium-4-ylpiperazin-1-yl)ethyl]-5-phenethylimidazolidine-2,4-dione Traditional Name: (5R)-3-[2-keto-2-(4-pyridin-1-ium-4-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=[NH+]C=C3)CCC4=CC=CC=C4

Isomeric SMILES

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

InChI

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