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

Systemtic Name: 2-(2-methylphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 4-[(3-morpholinopropylamino)methylene]-2-(o-tolyl)isoquinoline-1,3-dione CAS Name: 2-(2-methylphenyl)-4-[[3-(4-morpholinyl)propylamino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(2-methylphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 4-[(3-morpholinopropylamino)methylene]-2-(o-tolyl)isoquinoline-1,3-quinone Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O

InChI

InChI=1S/C24H27N3O3/c1-18-7-2-5-10-22(18)27-23(28)20-9-4-3-8-19(20)21(24(27)29)17-25-11-6-12-26-13-15-30-16-14-26/h2-5,7-10,17,25H,6,11-16H2,1H3