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

Systemtic Name: 6,7-dimethoxy-3-[oxidanyl-(3-phenylpropylamino)methylidene]-1H-quinoline-2,4-dione Openeye Name: 3-[hydroxy-(3-phenylpropylamino)methylene]-6,7-dimethoxy-1H-quinoline-2,4-dione CAS Name: 3-[hydroxy-(3-phenylpropylamino)methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione IUPAC Name: 3-[hydroxy-(3-phenylpropylamino)methylidene]-6,7-dimethoxy-1H-quinoline-2,4-dione Traditional Name: 3-[hydroxy-(3-phenylpropylamino)methylene]-6,7-dimethoxy-1H-quinoline-2,4-quinone Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C(=C(NCCCC3=CC=CC=C3)O)C(=O)N2)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)C(=C(NCCCC3=CC=CC=C3)O)C(=O)N2)OC

InChI

InChI=1S/C21H22N2O5/c1-27-16-11-14-15(12-17(16)28-2)23-21(26)18(19(14)24)20(25)22-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,11-12,22,25H,6,9-10H2,1-2H3,(H,23,26)