5-butyl-5-methyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]imidazolidine-2,4-dione

Systemtic Name: 5-butyl-5-methyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]imidazolidine-2,4-dione Openeye Name: 5-butyl-5-methyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]imidazolidine-2,4-dione CAS Name: 5-butyl-5-methyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methyl]imidazolidine-2,4-dione IUPAC Name: 5-butyl-5-methyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]imidazolidine-2,4-dione Traditional Name: 5-butyl-5-methyl-3-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]methyl]hydantoin Formula: C20H26F3N5O4 MolecularWeight: 457.44675

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)N(C(=O)N1)CN2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C

Isomeric SMILES

CCCCC1(C(=O)N(C(=O)N1)CN2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C

InChI

InChI=1S/C20H26F3N5O4/c1-3-4-7-19(2)17(29)27(18(30)24-19)13-25-8-10-26(11-9-25)15-6-5-14(20(21,22)23)12-16(15)28(31)32/h5-6,12H,3-4,7-11,13H2,1-2H3,(H,24,30)