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

Systemtic Name: 4-[(4-chlorophenyl)methyl]-2-(1-methylazocan-4-yl)phthalazin-1-one Openeye Name: 4-[(4-chlorophenyl)methyl]-2-(1-methylazocan-4-yl)phthalazin-1-one CAS Name: 4-[(4-chlorophenyl)methyl]-2-(1-methyl-4-azocanyl)-1-phthalazinone IUPAC Name: 4-[(4-chlorophenyl)methyl]-2-(1-methylazocan-4-yl)phthalazin-1-one Traditional Name: 4-(4-chlorobenzyl)-2-(1-methylazocan-4-yl)phthalazin-1-one Formula: C23H26ClN3O MolecularWeight: 395.92504

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1CCCCC(CC1)N2C(=O)C3=CC=CC=C3C(=N2)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H26ClN3O/c1-26-14-5-4-6-19(13-15-26)27-23(28)21-8-3-2-7-20(21)22(25-27)16-17-9-11-18(24)12-10-17/h2-3,7-12,19H,4-6,13-16H2,1H3