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

Systemtic Name: (5R)-3-but-2-ynyl-5-[1-[(2-oxidanylnaphthalen-1-yl)methyl]piperidin-1-ium-4-yl]-5-phenethyl-imidazolidine-2,4-dione Openeye Name: (5R)-3-but-2-ynyl-5-[1-[(2-hydroxy-1-naphthyl)methyl]piperidin-1-ium-4-yl]-5-phenethyl-imidazolidine-2,4-dione CAS Name: (5R)-3-but-2-ynyl-5-[1-[(2-hydroxy-1-naphthalenyl)methyl]-4-piperidin-1-iumyl]-5-phenethylimidazolidine-2,4-dione IUPAC Name: (5R)-3-but-2-ynyl-5-[1-[(2-hydroxynaphthalen-1-yl)methyl]piperidin-1-ium-4-yl]-5-phenethylimidazolidine-2,4-dione Traditional Name: (5R)-3-but-2-ynyl-5-[1-[(2-hydroxy-1-naphthyl)methyl]piperidin-1-ium-4-yl]-5-phenethyl-hydantoin Formula: C31H34N3O3+ MolecularWeight: 496.61996

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C(=O)C(NC1=O)(CCC2=CC=CC=C2)C3CC[NH+](CC3)CC4=C(C=CC5=CC=CC=C54)O

Isomeric SMILES

CC#CCN1C(=O)[C@@](NC1=O)(CCC2=CC=CC=C2)C3CC[NH+](CC3)CC4=C(C=CC5=CC=CC=C54)O

InChI

InChI=1S/C31H33N3O3/c1-2-3-19-34-29(36)31(32-30(34)37,18-15-23-9-5-4-6-10-23)25-16-20-33(21-17-25)22-27-26-12-8-7-11-24(26)13-14-28(27)35/h4-14,25,35H,15-22H2,1H3,(H,32,37)/p+1/t31-/m1/s1