1-cyclopentyl-3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]imidazolidine-2,4,5-trione

Systemtic Name: 1-cyclopentyl-3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]imidazolidine-2,4,5-trione Openeye Name: 1-cyclopentyl-3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]imidazolidine-2,4,5-trione CAS Name: 1-cyclopentyl-3-[[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]methyl]imidazolidine-2,4,5-trione IUPAC Name: 1-cyclopentyl-3-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]imidazolidine-2,4,5-trione Traditional Name: 1-cyclopentyl-3-[(4-o-phenetylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4,5-trione Formula: C21H29N4O4+ MolecularWeight: 401.47936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CN3C(=O)C(=O)N(C3=O)C4CCCC4

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CN3C(=O)C(=O)N(C3=O)C4CCCC4

InChI

InChI=1S/C21H28N4O4/c1-2-29-18-10-6-5-9-17(18)23-13-11-22(12-14-23)15-24-19(26)20(27)25(21(24)28)16-7-3-4-8-16/h5-6,9-10,16H,2-4,7-8,11-15H2,1H3/p+1