2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(4-methylphenyl)phthalazin-1-one

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(4-methylphenyl)phthalazin-1-one Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(p-tolyl)phthalazin-1-one CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(4-methylphenyl)-1-phthalazinone IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(4-methylphenyl)phthalazin-1-one Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-(p-tolyl)phthalazin-1-one Formula: C25H23N3O MolecularWeight: 381.46962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CN4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C25H23N3O/c1-18-10-12-20(13-11-18)24-22-8-4-5-9-23(22)25(29)28(26-24)17-27-15-14-19-6-2-3-7-21(19)16-27/h2-13H,14-17H2,1H3