2-[(E)-6-(dimethylamino)-1-(4-methoxyphenyl)hex-1-en-3-yl]phthalazin-1-one

Systemtic Name: 2-[(E)-6-(dimethylamino)-1-(4-methoxyphenyl)hex-1-en-3-yl]phthalazin-1-one Openeye Name: 2-[4-(dimethylamino)-1-[(E)-2-(4-methoxyphenyl)vinyl]butyl]phthalazin-1-one CAS Name: 2-[(E)-6-(dimethylamino)-1-(4-methoxyphenyl)hex-1-en-3-yl]-1-phthalazinone IUPAC Name: 2-[(E)-6-(dimethylamino)-1-(4-methoxyphenyl)hex-1-en-3-yl]phthalazin-1-one Traditional Name: 2-[(E)-1-[3-(dimethylamino)propyl]-3-(4-methoxyphenyl)allyl]phthalazin-1-one Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC(C=CC1=CC=C(C=C1)OC)N2C(=O)C3=CC=CC=C3C=N2

Isomeric SMILES

CN(C)CCCC(/C=C/C1=CC=C(C=C1)OC)N2C(=O)C3=CC=CC=C3C=N2

InChI

InChI=1S/C23H27N3O2/c1-25(2)16-6-8-20(13-10-18-11-14-21(28-3)15-12-18)26-23(27)22-9-5-4-7-19(22)17-24-26/h4-5,7,9-15,17,20H,6,8,16H2,1-3H3/b13-10+