(5R)-3-but-2-ynyl-5-phenethyl-5-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione

Systemtic Name: (5R)-3-but-2-ynyl-5-phenethyl-5-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione Openeye Name: (5R)-3-but-2-ynyl-5-phenethyl-5-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione CAS Name: (5R)-3-but-2-ynyl-5-phenethyl-5-[1-(3-phenylpropyl)-4-piperidin-1-iumyl]imidazolidine-2,4-dione IUPAC Name: (5R)-3-but-2-ynyl-5-phenethyl-5-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione Traditional Name: (5R)-3-but-2-ynyl-5-phenethyl-5-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]hydantoin Formula: C29H36N3O2+ MolecularWeight: 458.61504

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C(=O)C(NC1=O)(CCC2=CC=CC=C2)C3CC[NH+](CC3)CCCC4=CC=CC=C4

Isomeric SMILES

CC#CCN1C(=O)[C@@](NC1=O)(CCC2=CC=CC=C2)C3CC[NH+](CC3)CCCC4=CC=CC=C4

InChI

InChI=1S/C29H35N3O2/c1-2-3-21-32-27(33)29(30-28(32)34,19-16-25-13-8-5-9-14-25)26-17-22-31(23-18-26)20-10-15-24-11-6-4-7-12-24/h4-9,11-14,26H,10,15-23H2,1H3,(H,30,34)/p+1/t29-/m1/s1