2-(4-imidazol-1-ylbutyl)-4-phenyl-phthalazin-1-one

Systemtic Name: 2-(4-imidazol-1-ylbutyl)-4-phenyl-phthalazin-1-one Openeye Name: 2-(4-imidazol-1-ylbutyl)-4-phenyl-phthalazin-1-one CAS Name: 2-[4-(1-imidazolyl)butyl]-4-phenyl-1-phthalazinone IUPAC Name: 2-(4-imidazol-1-ylbutyl)-4-phenylphthalazin-1-one Traditional Name: 2-(4-imidazol-1-ylbutyl)-4-phenyl-phthalazin-1-one Formula: C21H20N4O MolecularWeight: 344.4097

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCCCN4C=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCCCN4C=CN=C4

InChI

InChI=1S/C21H20N4O/c26-21-19-11-5-4-10-18(19)20(17-8-2-1-3-9-17)23-25(21)14-7-6-13-24-15-12-22-16-24/h1-5,8-12,15-16H,6-7,13-14H2