4-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione

Systemtic Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione Openeye Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylene]-2-(2-pyridyl)isoquinoline-1,3-dione CAS Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]-2-(2-pyridinyl)isoquinoline-1,3-dione IUPAC Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylidene]-2-pyridin-2-ylisoquinoline-1,3-dione Traditional Name: 4-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)methylene]-2-(2-pyridyl)isoquinoline-1,3-quinone Formula: C23H17N3O4 MolecularWeight: 399.39878

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC=C3C4=CC=CC=C4C(=O)N(C3=O)C5=CC=CC=N5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC=C3C4=CC=CC=C4C(=O)N(C3=O)C5=CC=CC=N5

InChI

InChI=1S/C23H17N3O4/c27-22-17-6-2-1-5-16(17)18(23(28)26(22)21-7-3-4-10-24-21)14-25-15-8-9-19-20(13-15)30-12-11-29-19/h1-10,13-14,25H,11-12H2