(4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxidanyl)methylidene]-5-(3-ethoxy-4-propoxy-phenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione

Systemtic Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(oxidanyl)methylidene]-5-(3-ethoxy-4-propoxy-phenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione Openeye Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-5-(3-ethoxy-4-propoxy-phenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione CAS Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxy-4-propoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione IUPAC Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-5-(3-ethoxy-4-propoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione Traditional Name: (4Z)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-5-(3-ethoxy-4-propoxy-phenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)pyrrolidine-2,3-quinone Formula: C32H30N2O7S MolecularWeight: 586.6548

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2/C(=C(\C3=CC4=C(C=C3)OCCO4)/O)/C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)C)OCC

InChI

InChI=1S/C32H30N2O7S/c1-4-12-39-22-10-7-19(16-24(22)38-5-2)28-27(29(35)20-8-11-23-25(17-20)41-14-13-40-23)30(36)31(37)34(28)32-33-21-9-6-18(3)15-26(21)42-32/h6-11,15-17,28,35H,4-5,12-14H2,1-3H3/b29-27-