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

Systemtic Name: (3Z)-6,7-dimethoxy-3-[oxidanyl-(pyridin-4-ylmethylamino)methylidene]-1H-quinoline-2,4-dione Openeye Name: (3Z)-3-[hydroxy-(4-pyridylmethylamino)methylene]-6,7-dimethoxy-1H-quinoline-2,4-dione CAS Name: (3Z)-3-[hydroxy-(pyridin-4-ylmethylamino)methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione IUPAC Name: (3Z)-3-[hydroxy-(pyridin-4-ylmethylamino)methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Traditional Name: (3Z)-3-[hydroxy-(4-pyridylmethylamino)methylene]-6,7-dimethoxy-1H-quinoline-2,4-quinone Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C(=C(NCC3=CC=NC=C3)O)C(=O)N2)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)/C(=C(\NCC3=CC=NC=C3)/O)/C(=O)N2)OC

InChI

InChI=1S/C18H17N3O5/c1-25-13-7-11-12(8-14(13)26-2)21-18(24)15(16(11)22)17(23)20-9-10-3-5-19-6-4-10/h3-8,20,23H,9H2,1-2H3,(H,21,24)/b17-15-