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

Systemtic Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-methyl-5-naphthalen-2-yl-imidazolidine-2,4-dione Openeye Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-methyl-5-(2-naphthyl)imidazolidine-2,4-dione CAS Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-4-iumyl]methyl]-5-methyl-5-(2-naphthalenyl)imidazolidine-2,4-dione IUPAC Name: (5R)-3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]methyl]-5-methyl-5-naphthalen-2-ylimidazolidine-2,4-dione Traditional Name: (5R)-5-methyl-5-(2-naphthyl)-3-[(4-piperonylpiperazin-4-ium-1-yl)methyl]hydantoin Formula: C27H29N4O4+ MolecularWeight: 473.54356

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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)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C[C@]1(C(=O)N(C(=O)N1)CN2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C27H28N4O4/c1-27(22-8-7-20-4-2-3-5-21(20)15-22)25(32)31(26(33)28-27)17-30-12-10-29(11-13-30)16-19-6-9-23-24(14-19)35-18-34-23/h2-9,14-15H,10-13,16-18H2,1H3,(H,28,33)/p+1/t27-/m1/s1