3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-2-methyl-3-oxidanyl-isoindol-1-one

Systemtic Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-2-methyl-3-oxidanyl-isoindol-1-one Openeye Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-3-hydroxy-2-methyl-isoindolin-1-one CAS Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-3-hydroxy-2-methyl-1-isoindolone IUPAC Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-3-hydroxy-2-methylisoindol-1-one Traditional Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-3-hydroxy-2-methyl-isoindolin-1-one Formula: C21H22Cl2N2O2 MolecularWeight: 405.31758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1(C(CC=C)C3=CC(=C(C=C3)Cl)Cl)O)C=CC(=C2)N(C)C

Isomeric SMILES

CN1C(=O)C2=C(C1(C(CC=C)C3=CC(=C(C=C3)Cl)Cl)O)C=CC(=C2)N(C)C

InChI

InChI=1S/C21H22Cl2N2O2/c1-5-6-16(13-7-10-18(22)19(23)11-13)21(27)17-9-8-14(24(2)3)12-15(17)20(26)25(21)4/h5,7-12,16,27H,1,6H2,2-4H3