N-[(E)-(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[(E)-(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(E)-(2-chloro-6-fluoro-phenyl)methyleneamino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[(E)-(2-chloro-6-fluoro-benzylidene)amino]-4-keto-phthalazine-1-carboxamide Formula: C23H16ClFN4O2 MolecularWeight: 434.850143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NN=CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N/N=C/C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C23H16ClFN4O2/c24-19-11-6-12-20(25)18(19)13-26-27-22(30)21-16-9-4-5-10-17(16)23(31)29(28-21)14-15-7-2-1-3-8-15/h1-13H,14H2,(H,27,30)/b26-13+