2-[(5-phenyl-1,2-oxazol-3-yl)methyl]phthalazin-1-one

Systemtic Name: 2-[(5-phenyl-1,2-oxazol-3-yl)methyl]phthalazin-1-one Openeye Name: 2-[(5-phenylisoxazol-3-yl)methyl]phthalazin-1-one CAS Name: 2-[(5-phenyl-3-isoxazolyl)methyl]-1-phthalazinone IUPAC Name: 2-[(5-phenyl-1,2-oxazol-3-yl)methyl]phthalazin-1-one Traditional Name: 2-[(5-phenylisoxazol-3-yl)methyl]phthalazin-1-one Formula: C18H13N3O2 MolecularWeight: 303.31472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CN3C(=O)C4=CC=CC=C4C=N3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CN3C(=O)C4=CC=CC=C4C=N3

InChI

InChI=1S/C18H13N3O2/c22-18-16-9-5-4-8-14(16)11-19-21(18)12-15-10-17(23-20-15)13-6-2-1-3-7-13/h1-11H,12H2