6-[(E)-2-(4-chlorophenyl)ethenyl]-2-[3-(dimethylamino)propyl]phthalazin-1-one

Systemtic Name: 6-[(E)-2-(4-chlorophenyl)ethenyl]-2-[3-(dimethylamino)propyl]phthalazin-1-one Openeye Name: 6-[(E)-2-(4-chlorophenyl)vinyl]-2-[3-(dimethylamino)propyl]phthalazin-1-one CAS Name: 6-[(E)-2-(4-chlorophenyl)ethenyl]-2-[3-(dimethylamino)propyl]-1-phthalazinone IUPAC Name: 6-[(E)-2-(4-chlorophenyl)ethenyl]-2-[3-(dimethylamino)propyl]phthalazin-1-one Traditional Name: 6-[(E)-2-(4-chlorophenyl)vinyl]-2-[3-(dimethylamino)propyl]phthalazin-1-one Formula: C21H22ClN3O MolecularWeight: 367.87188

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C(=O)C2=C(C=C(C=C2)C=CC3=CC=C(C=C3)Cl)C=N1

Isomeric SMILES

CN(C)CCCN1C(=O)C2=C(C=C(C=C2)/C=C/C3=CC=C(C=C3)Cl)C=N1

InChI

InChI=1S/C21H22ClN3O/c1-24(2)12-3-13-25-21(26)20-11-8-17(14-18(20)15-23-25)5-4-16-6-9-19(22)10-7-16/h4-11,14-15H,3,12-13H2,1-2H3/b5-4+