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

Systemtic Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-cyclopropyl-5-methyl-imidazolidine-2,4-dione Openeye Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-cyclopropyl-5-methyl-imidazolidine-2,4-dione CAS Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-4-iumyl]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione IUPAC Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-cyclopropyl-5-methylimidazolidine-2,4-dione Traditional Name: (5R)-5-cyclopropyl-5-methyl-3-[(4-piperonylpiperazin-4-ium-1-yl)methyl]hydantoin Formula: C20H27N4O4+ MolecularWeight: 387.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)CN2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4)C5CC5

Isomeric SMILES

C[C@]1(C(=O)N(C(=O)N1)CN2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4)C5CC5

InChI

InChI=1S/C20H26N4O4/c1-20(15-3-4-15)18(25)24(19(26)21-20)12-23-8-6-22(7-9-23)11-14-2-5-16-17(10-14)28-13-27-16/h2,5,10,15H,3-4,6-9,11-13H2,1H3,(H,21,26)/p+1/t20-/m1/s1