4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-pentyl-phthalazin-1-one

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2-pentyl-phthalazin-1-one Openeye Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-pentyl-phthalazin-1-one CAS Name: 4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-pentyl-1-phthalazinone IUPAC Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-pentylphthalazin-1-one Traditional Name: 2-amyl-4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phthalazin-1-one Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H25N3O2/c1-2-3-8-14-26-22(27)20-12-7-6-11-19(20)21(24-26)23(28)25-15-13-17-9-4-5-10-18(17)16-25/h4-7,9-12H,2-3,8,13-16H2,1H3