(5R)-3-[[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenethyl-imidazolidine-2,4-dione

Systemtic Name: (5R)-3-[[4-(azepan-1-ylcarbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenethyl-imidazolidine-2,4-dione Openeye Name: (5R)-3-[[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenethyl-imidazolidine-2,4-dione CAS Name: (5R)-3-[[4-[1-azepanyl(oxo)methyl]-1-piperidin-1-iumyl]methyl]-5-methyl-5-phenethylimidazolidine-2,4-dione IUPAC Name: (5R)-3-[[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenethylimidazolidine-2,4-dione Traditional Name: (5R)-3-[[4-(azepane-1-carbonyl)piperidin-1-ium-1-yl]methyl]-5-methyl-5-phenethyl-hydantoin Formula: C25H37N4O3+ MolecularWeight: 441.58628

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)C[NH+]2CCC(CC2)C(=O)N3CCCCCC3)CCC4=CC=CC=C4

Isomeric SMILES

C[C@]1(C(=O)N(C(=O)N1)C[NH+]2CCC(CC2)C(=O)N3CCCCCC3)CCC4=CC=CC=C4

InChI

InChI=1S/C25H36N4O3/c1-25(14-11-20-9-5-4-6-10-20)23(31)29(24(32)26-25)19-27-17-12-21(13-18-27)22(30)28-15-7-2-3-8-16-28/h4-6,9-10,21H,2-3,7-8,11-19H2,1H3,(H,26,32)/p+1/t25-/m1/s1