(4E)-5-(4-butoxy-3-ethoxy-phenyl)-1-[3-(dibutylamino)propyl]-4-[oxidanyl-(4-phenylmethoxyphenyl)methylidene]pyrrolidine-2,3-dione

Systemtic Name: (4E)-5-(4-butoxy-3-ethoxy-phenyl)-1-[3-(dibutylamino)propyl]-4-[oxidanyl-(4-phenylmethoxyphenyl)methylidene]pyrrolidine-2,3-dione Openeye Name: (4E)-4-[(4-benzyloxyphenyl)-hydroxy-methylene]-5-(4-butoxy-3-ethoxy-phenyl)-1-[3-(dibutylamino)propyl]pyrrolidine-2,3-dione CAS Name: (4E)-5-(4-butoxy-3-ethoxyphenyl)-1-[3-(dibutylamino)propyl]-4-[hydroxy-(4-phenylmethoxyphenyl)methylidene]pyrrolidine-2,3-dione IUPAC Name: (4E)-5-(4-butoxy-3-ethoxyphenyl)-1-[3-(dibutylamino)propyl]-4-[hydroxy-(4-phenylmethoxyphenyl)methylidene]pyrrolidine-2,3-dione Traditional Name: (4E)-4-[(4-benzoxyphenyl)-hydroxy-methylene]-5-(4-butoxy-3-ethoxy-phenyl)-1-[3-(dibutylamino)propyl]pyrrolidine-2,3-quinone Formula: C41H54N2O6 MolecularWeight: 670.87726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCN1C(C(=C(C2=CC=C(C=C2)OCC3=CC=CC=C3)O)C(=O)C1=O)C4=CC(=C(C=C4)OCCCC)OCC

Isomeric SMILES

CCCCN(CCCC)CCCN1C(/C(=C(/C2=CC=C(C=C2)OCC3=CC=CC=C3)\O)/C(=O)C1=O)C4=CC(=C(C=C4)OCCCC)OCC

InChI

InChI=1S/C41H54N2O6/c1-5-9-24-42(25-10-6-2)26-15-27-43-38(33-20-23-35(48-28-11-7-3)36(29-33)47-8-4)37(40(45)41(43)46)39(44)32-18-21-34(22-19-32)49-30-31-16-13-12-14-17-31/h12-14,16-23,29,38,44H,5-11,15,24-28,30H2,1-4H3/b39-37+