(5S)-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-propyl-imidazolidine-2,4-dione

Systemtic Name: (5S)-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-propyl-imidazolidine-2,4-dione Openeye Name: (5S)-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-propyl-imidazolidine-2,4-dione CAS Name: (5S)-3-[[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-5-propylimidazolidine-2,4-dione IUPAC Name: (5S)-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-propylimidazolidine-2,4-dione Traditional Name: (5S)-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-propyl-hydantoin Formula: C18H27N4O3+ MolecularWeight: 347.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC[C@H]1C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H26N4O3/c1-3-4-16-17(23)22(18(24)19-16)13-20-9-11-21(12-10-20)14-5-7-15(25-2)8-6-14/h5-8,16H,3-4,9-13H2,1-2H3,(H,19,24)/p+1/t16-/m0/s1