4-[(4-chlorophenyl)methyl]-2-(1-methylazepin-4-yl)phthalazin-1-one

Systemtic Name: 4-[(4-chlorophenyl)methyl]-2-(1-methylazepin-4-yl)phthalazin-1-one Openeye Name: 4-[(4-chlorophenyl)methyl]-2-(1-methylazepin-4-yl)phthalazin-1-one CAS Name: 4-[(4-chlorophenyl)methyl]-2-(1-methyl-4-azepinyl)-1-phthalazinone IUPAC Name: 4-[(4-chlorophenyl)methyl]-2-(1-methylazepin-4-yl)phthalazin-1-one Traditional Name: 4-(4-chlorobenzyl)-2-(1-methylazepin-4-yl)phthalazin-1-one Formula: C22H18ClN3O MolecularWeight: 375.85082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3O/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16/h2-14H,15H2,1H3