2-(3-chloranyl-2-methyl-phenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(3-chloranyl-2-methyl-phenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(3-chloro-2-methyl-phenyl)-4-[(3-morpholinopropylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-(3-chloro-2-methylphenyl)-4-[[3-(4-morpholinyl)propylamino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(3-chloro-2-methylphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(3-chloro-2-methyl-phenyl)-4-[(3-morpholinopropylamino)methylene]isoquinoline-1,3-quinone Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O

InChI

InChI=1S/C24H26ClN3O3/c1-17-21(25)8-4-9-22(17)28-23(29)19-7-3-2-6-18(19)20(24(28)30)16-26-10-5-11-27-12-14-31-15-13-27/h2-4,6-9,16,26H,5,10-15H2,1H3