(3Z)-3-[(1,3-benzodioxol-5-ylmethylamino)-oxidanyl-methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione

Systemtic Name: (3Z)-3-[(1,3-benzodioxol-5-ylmethylamino)-oxidanyl-methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Openeye Name: (3Z)-3-[(1,3-benzodioxol-5-ylmethylamino)-hydroxy-methylene]-6,7-dimethoxy-1H-quinoline-2,4-dione CAS Name: (3Z)-3-[(1,3-benzodioxol-5-ylmethylamino)-hydroxymethylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione IUPAC Name: (3Z)-3-[(1,3-benzodioxol-5-ylmethylamino)-hydroxymethylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Traditional Name: (3Z)-3-[hydroxy-(piperonylamino)methylene]-6,7-dimethoxy-1H-quinoline-2,4-quinone Formula: C20H18N2O7 MolecularWeight: 398.36612

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C(=C(NCC3=CC4=C(C=C3)OCO4)O)C(=O)N2)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)/C(=C(\NCC3=CC4=C(C=C3)OCO4)/O)/C(=O)N2)OC

InChI

InChI=1S/C20H18N2O7/c1-26-14-6-11-12(7-15(14)27-2)22-20(25)17(18(11)23)19(24)21-8-10-3-4-13-16(5-10)29-9-28-13/h3-7,21,24H,8-9H2,1-2H3,(H,22,25)/b19-17-