2-[(7-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(7-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(7-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]isoindoline-1,3-dione CAS Name: 2-[(7-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(7-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(7-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)methyl]isoindoline-1,3-quinone Formula: C25H17ClN2O3 MolecularWeight: 428.86708

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=C(C=C2)Cl)C3=CC=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=C(C=C2)Cl)C3=CC=CC=C3)CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H17ClN2O3/c1-27-21(14-28-24(30)18-9-5-6-10-19(18)25(28)31)22(15-7-3-2-4-8-15)17-12-11-16(26)13-20(17)23(27)29/h2-13H,14H2,1H3