2-(6-chloranyl-2-methyl-1-oxidanylidene-4-phenylmethoxy-isoquinolin-3-yl)isoindole-1,3-dione

Systemtic Name: 2-(6-chloranyl-2-methyl-1-oxidanylidene-4-phenylmethoxy-isoquinolin-3-yl)isoindole-1,3-dione Openeye Name: 2-(4-benzyloxy-6-chloro-2-methyl-1-oxo-3-isoquinolyl)isoindoline-1,3-dione CAS Name: 2-(6-chloro-2-methyl-1-oxo-4-phenylmethoxy-3-isoquinolinyl)isoindole-1,3-dione IUPAC Name: 2-(6-chloro-2-methyl-1-oxo-4-phenylmethoxyisoquinolin-3-yl)isoindole-1,3-dione Traditional Name: 2-(4-benzoxy-6-chloro-1-keto-2-methyl-3-isoquinolyl)isoindoline-1,3-quinone Formula: C25H17ClN2O4 MolecularWeight: 444.86648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)OCC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)OCC3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H17ClN2O4/c1-27-22(28-24(30)17-9-5-6-10-18(17)25(28)31)21(32-14-15-7-3-2-4-8-15)20-13-16(26)11-12-19(20)23(27)29/h2-13H,14H2,1H3