2-(2-ethoxyphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(2-ethoxyphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(2-ethoxyphenyl)-4-[(3-morpholinopropylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-(2-ethoxyphenyl)-4-[[3-(4-morpholinyl)propylamino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(2-ethoxyphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 4-[(3-morpholinopropylamino)methylene]-2-o-phenetyl-isoquinoline-1,3-quinone Formula: C25H29N3O4 MolecularWeight: 435.51546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O

InChI

InChI=1S/C25H29N3O4/c1-2-32-23-11-6-5-10-22(23)28-24(29)20-9-4-3-8-19(20)21(25(28)30)18-26-12-7-13-27-14-16-31-17-15-27/h3-6,8-11,18,26H,2,7,12-17H2,1H3