(5S)-5-[1-[(3,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-5-phenethyl-imidazolidine-2,4-dione

Systemtic Name: (5S)-5-[1-[(3,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-5-phenethyl-imidazolidine-2,4-dione Openeye Name: (5S)-5-[1-[(3,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-5-phenethyl-imidazolidine-2,4-dione CAS Name: (5S)-5-[1-[(3,5-dimethoxyphenyl)methyl]-4-piperidin-1-iumyl]-5-phenethylimidazolidine-2,4-dione IUPAC Name: (5S)-5-[1-[(3,5-dimethoxyphenyl)methyl]piperidin-1-ium-4-yl]-5-phenethylimidazolidine-2,4-dione Traditional Name: (5S)-5-[1-(3,5-dimethoxybenzyl)piperidin-1-ium-4-yl]-5-phenethyl-hydantoin Formula: C25H32N3O4+ MolecularWeight: 438.53928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C[NH+]2CCC(CC2)C3(C(=O)NC(=O)N3)CCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C[NH+]2CCC(CC2)[C@]3(C(=O)NC(=O)N3)CCC4=CC=CC=C4)OC

InChI

InChI=1S/C25H31N3O4/c1-31-21-14-19(15-22(16-21)32-2)17-28-12-9-20(10-13-28)25(23(29)26-24(30)27-25)11-8-18-6-4-3-5-7-18/h3-7,14-16,20H,8-13,17H2,1-2H3,(H2,26,27,29,30)/p+1/t25-/m0/s1