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

Systemtic Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-2-methyl-3H-isoindol-1-one Openeye Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-2-methyl-isoindolin-1-one CAS Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-2-methyl-3H-isoindol-1-one IUPAC Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-2-methyl-3H-isoindol-1-one Traditional Name: 3-[1-(3,4-dichlorophenyl)but-3-enyl]-6-(dimethylamino)-2-methyl-isoindolin-1-one Formula: C21H22Cl2N2O MolecularWeight: 389.31818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22Cl2N2O/c1-5-6-15(13-7-10-18(22)19(23)11-13)20-16-9-8-14(24(2)3)12-17(16)21(26)25(20)4/h5,7-12,15,20H,1,6H2,2-4H3