2-[3-(6-methoxy-2H-chromen-4-yl)propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(6-methoxy-2H-chromen-4-yl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-(6-methoxy-2H-chromen-4-yl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(6-methoxy-2H-1-benzopyran-4-yl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(6-methoxy-2H-chromen-4-yl)propyl]isoindole-1,3-dione Traditional Name: 2-[3-(6-methoxy-2H-chromen-4-yl)propyl]isoindoline-1,3-quinone Formula: C21H19NO4 MolecularWeight: 349.37986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC=C2CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC2=C(C=C1)OCC=C2CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19NO4/c1-25-15-8-9-19-18(13-15)14(10-12-26-19)5-4-11-22-20(23)16-6-2-3-7-17(16)21(22)24/h2-3,6-10,13H,4-5,11-12H2,1H3