4-[[[3-(hydroxymethyl)phenyl]amino]methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione

Systemtic Name: 4-[[[3-(hydroxymethyl)phenyl]amino]methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione Openeye Name: 4-[[3-(hydroxymethyl)anilino]methylene]-2-(2-pyridyl)isoquinoline-1,3-dione CAS Name: 4-[[3-(hydroxymethyl)anilino]methylidene]-2-(2-pyridinyl)isoquinoline-1,3-dione IUPAC Name: 4-[[3-(hydroxymethyl)anilino]methylidene]-2-pyridin-2-ylisoquinoline-1,3-dione Traditional Name: 4-[(3-methylolanilino)methylene]-2-(2-pyridyl)isoquinoline-1,3-quinone Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNC3=CC=CC(=C3)CO)C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNC3=CC=CC(=C3)CO)C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C22H17N3O3/c26-14-15-6-5-7-16(12-15)24-13-19-17-8-1-2-9-18(17)21(27)25(22(19)28)20-10-3-4-11-23-20/h1-13,24,26H,14H2