3-(3,5-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(3,5-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3,5-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3,5-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3,5-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3,5-dimethoxyphenyl)-N-(4-fluorobenzyl)-4-keto-phthalazine-1-carboxamide Formula: C24H20FN3O4 MolecularWeight: 433.431703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=C(C=C4)F)OC

InChI

InChI=1S/C24H20FN3O4/c1-31-18-11-17(12-19(13-18)32-2)28-24(30)21-6-4-3-5-20(21)22(27-28)23(29)26-14-15-7-9-16(25)10-8-15/h3-13H,14H2,1-2H3,(H,26,29)