(2E)-2-(1,3-benzodioxol-5-ylmethylidene)-1-(2-oxidanyl-4-oxidanylidene-1-phenyl-quinolin-3-yl)butane-1,3-dione

Systemtic Name: (2E)-2-(1,3-benzodioxol-5-ylmethylidene)-1-(2-oxidanyl-4-oxidanylidene-1-phenyl-quinolin-3-yl)butane-1,3-dione Openeye Name: (2E)-2-(1,3-benzodioxol-5-ylmethylene)-1-(2-hydroxy-4-oxo-1-phenyl-3-quinolyl)butane-1,3-dione CAS Name: (2E)-2-(1,3-benzodioxol-5-ylmethylidene)-1-(2-hydroxy-4-oxo-1-phenyl-3-quinolinyl)butane-1,3-dione IUPAC Name: (2E)-2-(1,3-benzodioxol-5-ylmethylidene)-1-(2-hydroxy-4-oxo-1-phenylquinolin-3-yl)butane-1,3-dione Traditional Name: (2E)-1-(2-hydroxy-4-keto-1-phenyl-3-quinolyl)-2-piperonylidene-butane-1,3-dione Formula: C27H19NO6 MolecularWeight: 453.44286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC2=C(C=C1)OCO2)C(=O)C3=C(N(C4=CC=CC=C4C3=O)C5=CC=CC=C5)O

Isomeric SMILES

CC(=O)/C(=C\C1=CC2=C(C=C1)OCO2)/C(=O)C3=C(N(C4=CC=CC=C4C3=O)C5=CC=CC=C5)O

InChI

InChI=1S/C27H19NO6/c1-16(29)20(13-17-11-12-22-23(14-17)34-15-33-22)26(31)24-25(30)19-9-5-6-10-21(19)28(27(24)32)18-7-3-2-4-8-18/h2-14,32H,15H2,1H3/b20-13+