(4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxidanyl)methylidene]-5-(3-ethoxy-4-phenylmethoxy-phenyl)-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione

Systemtic Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxidanyl)methylidene]-5-(3-ethoxy-4-phenylmethoxy-phenyl)-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione Openeye Name: (4Z)-5-(4-benzyloxy-3-ethoxy-phenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione CAS Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxy-4-phenylmethoxyphenyl)-1-[3-(1-imidazolyl)propyl]pyrrolidine-2,3-dione IUPAC Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxy-4-phenylmethoxyphenyl)-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-dione Traditional Name: (4Z)-5-(4-benzoxy-3-ethoxy-phenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-1-(3-imidazol-1-ylpropyl)pyrrolidine-2,3-quinone Formula: C34H33N3O7 MolecularWeight: 595.64172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCCN5C=CN=C5)OCC6=CC=CC=C6

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2/C(=C(\C3=CC4=C(C=C3)OCCO4)/O)/C(=O)C(=O)N2CCCN5C=CN=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C34H33N3O7/c1-2-41-28-19-24(9-11-27(28)44-21-23-7-4-3-5-8-23)31-30(32(38)25-10-12-26-29(20-25)43-18-17-42-26)33(39)34(40)37(31)15-6-14-36-16-13-35-22-36/h3-5,7-13,16,19-20,22,31,38H,2,6,14-15,17-18,21H2,1H3/b32-30-