4-phenyl-2-(2-pyridin-2-ylethyl)phthalazin-1-one

Systemtic Name: 4-phenyl-2-(2-pyridin-2-ylethyl)phthalazin-1-one Openeye Name: 4-phenyl-2-[2-(2-pyridyl)ethyl]phthalazin-1-one CAS Name: 4-phenyl-2-[2-(2-pyridinyl)ethyl]-1-phthalazinone IUPAC Name: 4-phenyl-2-(2-pyridin-2-ylethyl)phthalazin-1-one Traditional Name: 4-phenyl-2-[2-(2-pyridyl)ethyl]phthalazin-1-one Formula: C21H17N3O MolecularWeight: 327.37918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC4=CC=CC=N4

InChI

InChI=1S/C21H17N3O/c25-21-19-12-5-4-11-18(19)20(16-8-2-1-3-9-16)23-24(21)15-13-17-10-6-7-14-22-17/h1-12,14H,13,15H2