3-[3-[4-[6-[[2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-oxidanyl-ethyl]amino]hexoxy]but-1-ynyl]phenyl]imidazolidine-2,4-dione

Systemtic Name: 3-[3-[4-[6-[[2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-oxidanyl-ethyl]amino]hexoxy]but-1-ynyl]phenyl]imidazolidine-2,4-dione Openeye Name: 3-[3-[4-[6-[[2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-hydroxy-ethyl]amino]hexoxy]but-1-ynyl]phenyl]imidazolidine-2,4-dione CAS Name: 3-[3-[4-[6-[[2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-hydroxyethyl]amino]hexoxy]but-1-ynyl]phenyl]imidazolidine-2,4-dione IUPAC Name: 3-[3-[4-[6-[[2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-hydroxyethyl]amino]hexoxy]but-1-ynyl]phenyl]imidazolidine-2,4-dione Traditional Name: 3-[3-[4-[6-[[2-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-hydroxy-ethyl]amino]hexoxy]but-1-ynyl]phenyl]hydantoin Formula: C31H39N3O6 MolecularWeight: 549.65786

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC2=C(O1)C=CC(=C2)C(CNCCCCCCOCCC#CC3=CC(=CC=C3)N4C(=O)CNC4=O)O)C

Isomeric SMILES

CC1(OCC2=C(O1)C=CC(=C2)C(CNCCCCCCOCCC#CC3=CC(=CC=C3)N4C(=O)CNC4=O)O)C

InChI

InChI=1S/C31H39N3O6/c1-31(2)39-22-25-19-24(13-14-28(25)40-31)27(35)20-32-15-6-3-4-7-16-38-17-8-5-10-23-11-9-12-26(18-23)34-29(36)21-33-30(34)37/h9,11-14,18-19,27,32,35H,3-4,6-8,15-17,20-22H2,1-2H3,(H,33,37)