2-[1-[4-butoxy-6,7-bis(chloranyl)-2-methyl-1-oxidanylidene-isoquinolin-3-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[1-[4-butoxy-6,7-bis(chloranyl)-2-methyl-1-oxidanylidene-isoquinolin-3-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[1-(4-butoxy-6,7-dichloro-2-methyl-1-oxo-3-isoquinolyl)ethyl]isoindoline-1,3-dione CAS Name: 2-[1-(4-butoxy-6,7-dichloro-2-methyl-1-oxo-3-isoquinolinyl)ethyl]isoindole-1,3-dione IUPAC Name: 2-[1-(4-butoxy-6,7-dichloro-2-methyl-1-oxoisoquinolin-3-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[1-(4-butoxy-6,7-dichloro-1-keto-2-methyl-3-isoquinolyl)ethyl]isoindoline-1,3-quinone Formula: C24H22Cl2N2O4 MolecularWeight: 473.34848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=CC(=C(C=C21)Cl)Cl)C)C(C)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=CC(=C(C=C21)Cl)Cl)C)C(C)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H22Cl2N2O4/c1-4-5-10-32-21-16-11-18(25)19(26)12-17(16)22(29)27(3)20(21)13(2)28-23(30)14-8-6-7-9-15(14)24(28)31/h6-9,11-13H,4-5,10H2,1-3H3