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

Systemtic Name: (5S)-5-[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]-5-phenethyl-imidazolidine-2,4-dione Openeye Name: (5S)-5-[1-(2-furylmethyl)piperidin-1-ium-4-yl]-5-phenethyl-imidazolidine-2,4-dione CAS Name: (5S)-5-[1-(2-furanylmethyl)-4-piperidin-1-iumyl]-5-phenethylimidazolidine-2,4-dione IUPAC Name: (5S)-5-[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]-5-phenethylimidazolidine-2,4-dione Traditional Name: (5S)-5-[1-(2-furfuryl)piperidin-1-ium-4-yl]-5-phenethyl-hydantoin Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2(C(=O)NC(=O)N2)CCC3=CC=CC=C3)CC4=CC=CO4

Isomeric SMILES

C1C[NH+](CCC1[C@]2(C(=O)NC(=O)N2)CCC3=CC=CC=C3)CC4=CC=CO4

InChI

InChI=1S/C21H25N3O3/c25-19-21(23-20(26)22-19,11-8-16-5-2-1-3-6-16)17-9-12-24(13-10-17)15-18-7-4-14-27-18/h1-7,14,17H,8-13,15H2,(H2,22,23,25,26)/p+1/t21-/m0/s1