3-[[(3,4-dimethoxyphenyl)methylamino]-oxidanyl-methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione

Systemtic Name: 3-[[(3,4-dimethoxyphenyl)methylamino]-oxidanyl-methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Openeye Name: 3-[[(3,4-dimethoxyphenyl)methylamino]-hydroxy-methylene]-6,7-dimethoxy-1H-quinoline-2,4-dione CAS Name: 3-[[(3,4-dimethoxyphenyl)methylamino]-hydroxymethylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione IUPAC Name: 3-[[(3,4-dimethoxyphenyl)methylamino]-hydroxymethylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Traditional Name: 3-[hydroxy-(veratrylamino)methylene]-6,7-dimethoxy-1H-quinoline-2,4-quinone Formula: C21H22N2O7 MolecularWeight: 414.40858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=C2C(=O)C3=CC(=C(C=C3NC2=O)OC)OC)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=C2C(=O)C3=CC(=C(C=C3NC2=O)OC)OC)O)OC

InChI

InChI=1S/C21H22N2O7/c1-27-14-6-5-11(7-15(14)28-2)10-22-20(25)18-19(24)12-8-16(29-3)17(30-4)9-13(12)23-21(18)26/h5-9,22,25H,10H2,1-4H3,(H,23,26)