(5S)-5-phenethyl-5-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione

Systemtic Name: (5S)-5-phenethyl-5-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione Openeye Name: (5S)-5-phenethyl-5-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione CAS Name: (5S)-5-phenethyl-5-[1-(pyridin-4-ylmethyl)-4-piperidin-1-iumyl]imidazolidine-2,4-dione IUPAC Name: (5S)-5-phenethyl-5-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione Traditional Name: (5S)-5-phenethyl-5-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]hydantoin Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2(C(=O)NC(=O)N2)CCC3=CC=CC=C3)CC4=CC=NC=C4

Isomeric SMILES

C1C[NH+](CCC1[C@]2(C(=O)NC(=O)N2)CCC3=CC=CC=C3)CC4=CC=NC=C4

InChI

InChI=1S/C22H26N4O2/c27-20-22(25-21(28)24-20,11-6-17-4-2-1-3-5-17)19-9-14-26(15-10-19)16-18-7-12-23-13-8-18/h1-5,7-8,12-13,19H,6,9-11,14-16H2,(H2,24,25,27,28)/p+1/t22-/m0/s1