4-(azepan-1-ylcarbonyl)-2-(2-methylpropyl)phthalazin-1-one

Systemtic Name: 4-(azepan-1-ylcarbonyl)-2-(2-methylpropyl)phthalazin-1-one Openeye Name: 4-(azepane-1-carbonyl)-2-isobutyl-phthalazin-1-one CAS Name: 4-[1-azepanyl(oxo)methyl]-2-(2-methylpropyl)-1-phthalazinone IUPAC Name: 4-(azepane-1-carbonyl)-2-(2-methylpropyl)phthalazin-1-one Traditional Name: 4-(azepane-1-carbonyl)-2-isobutyl-phthalazin-1-one Formula: C19H25N3O2 MolecularWeight: 327.4207

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCCCC3

InChI

InChI=1S/C19H25N3O2/c1-14(2)13-22-18(23)16-10-6-5-9-15(16)17(20-22)19(24)21-11-7-3-4-8-12-21/h5-6,9-10,14H,3-4,7-8,11-13H2,1-2H3