2-(2,5-dimethoxyphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(2,5-dimethoxyphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(2,5-dimethoxyphenyl)-4-[(3-morpholinopropylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-(2,5-dimethoxyphenyl)-4-[[3-(4-morpholinyl)propylamino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(2,5-dimethoxyphenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(2,5-dimethoxyphenyl)-4-[(3-morpholinopropylamino)methylene]isoquinoline-1,3-quinone Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3C(=CNCCCN4CCOCC4)C2=O

InChI

InChI=1S/C25H29N3O5/c1-31-18-8-9-23(32-2)22(16-18)28-24(29)20-7-4-3-6-19(20)21(25(28)30)17-26-10-5-11-27-12-14-33-15-13-27/h3-4,6-9,16-17,26H,5,10-15H2,1-2H3