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

Systemtic Name: 2-(3-chloranyl-4-methyl-phenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(3-chloro-4-methyl-phenyl)-4-[(3-morpholinopropylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-(3-chloro-4-methylphenyl)-4-[[3-(4-morpholinyl)propylamino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(3-chloro-4-methylphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(3-chloro-4-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=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O)Cl

InChI

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