N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-ethyl-N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-ethyl-N-[(3-fluoro-4-methoxy-phenyl)methyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-ethyl-N-(3-fluoro-4-methoxy-benzyl)-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C25H22FN3O3 MolecularWeight: 431.458883

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H22FN3O3/c1-3-28(16-17-13-14-22(32-2)21(26)15-17)25(31)23-19-11-7-8-12-20(19)24(30)29(27-23)18-9-5-4-6-10-18/h4-15H,3,16H2,1-2H3