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

Systemtic Name: 3-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxidanyl-methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Openeye Name: 3-[[2-(3,4-dimethoxyphenyl)ethylamino]-hydroxy-methylene]-6,7-dimethoxy-1H-quinoline-2,4-dione CAS Name: 3-[[2-(3,4-dimethoxyphenyl)ethylamino]-hydroxymethylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione IUPAC Name: 3-[[2-(3,4-dimethoxyphenyl)ethylamino]-hydroxymethylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Traditional Name: 3-[(homoveratrylamino)-hydroxy-methylene]-6,7-dimethoxy-1H-quinoline-2,4-quinone Formula: C22H24N2O7 MolecularWeight: 428.43516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O7/c1-28-15-6-5-12(9-16(15)29-2)7-8-23-21(26)19-20(25)13-10-17(30-3)18(31-4)11-14(13)24-22(19)27/h5-6,9-11,23,26H,7-8H2,1-4H3,(H,24,27)