(5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-phenyl-5-propyl-imidazolidine-2,4-dione

Systemtic Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-phenyl-5-propyl-imidazolidine-2,4-dione Openeye Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-phenyl-5-propyl-imidazolidine-2,4-dione CAS Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-4-iumyl]methyl]-5-phenyl-5-propylimidazolidine-2,4-dione IUPAC Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-phenyl-5-propylimidazolidine-2,4-dione Traditional Name: (5R)-5-phenyl-3-[(4-piperonylpiperazin-4-ium-1-yl)methyl]-5-propyl-hydantoin Formula: C25H31N4O4+ MolecularWeight: 451.53804

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=O)N(C(=O)N1)CN2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CCC[C@]1(C(=O)N(C(=O)N1)CN2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

InChI

InChI=1S/C25H30N4O4/c1-2-10-25(20-6-4-3-5-7-20)23(30)29(24(31)26-25)17-28-13-11-27(12-14-28)16-19-8-9-21-22(15-19)33-18-32-21/h3-9,15H,2,10-14,16-18H2,1H3,(H,26,31)/p+1/t25-/m1/s1