2-(2-dimethylaminoethyl)-6-[(E)-2-(4-methoxyphenyl)ethenyl]phthalazin-1-one hydrobromide

Systemtic Name: 2-(2-dimethylaminoethyl)-6-[(E)-2-(4-methoxyphenyl)ethenyl]phthalazin-1-one hydrobromide Openeye Name: 2-(2-dimethylaminoethyl)-6-[(E)-2-(4-methoxyphenyl)vinyl]phthalazin-1-one hydrobromide CAS Name: 2-(2-dimethylaminoethyl)-6-[(E)-2-(4-methoxyphenyl)ethenyl]-1-phthalazinone hydrobromide IUPAC Name: 2-(2-dimethylaminoethyl)-6-[(E)-2-(4-methoxyphenyl)ethenyl]phthalazin-1-one hydrobromide Traditional Name: 2-(2-dimethylaminoethyl)-6-[(E)-2-(4-methoxyphenyl)vinyl]phthalazin-1-one hydrobromide Formula: C21H24BrN3O2 MolecularWeight: 430.33816

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=O)C2=C(C=C(C=C2)C=CC3=CC=C(C=C3)OC)C=N1.Br

Isomeric SMILES

CN(C)CCN1C(=O)C2=C(C=C(C=C2)/C=C/C3=CC=C(C=C3)OC)C=N1.Br

InChI

InChI=1S/C21H23N3O2.BrH/c1-23(2)12-13-24-21(25)20-11-8-17(14-18(20)15-22-24)5-4-16-6-9-19(26-3)10-7-16;/h4-11,14-15H,12-13H2,1-3H3;1H/b5-4+;