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

Systemtic Name: (5R)-5-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione Openeye Name: (5R)-5-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione CAS Name: (5R)-5-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-[[4-(4-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]imidazolidine-2,4-dione IUPAC Name: (5R)-5-(1,3-benzodioxol-5-ylmethyl)-5-methyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione Traditional Name: (5R)-5-methyl-5-piperonyl-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]hydantoin Formula: C22H27N5O4+2 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)C3=CC=[NH+]C=C3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C[C@]1(C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)C3=CC=[NH+]C=C3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H25N5O4/c1-22(13-16-2-3-18-19(12-16)31-15-30-18)20(28)27(21(29)24-22)14-25-8-10-26(11-9-25)17-4-6-23-7-5-17/h2-7,12H,8-11,13-15H2,1H3,(H,24,29)/p+2/t22-/m1/s1