N-[4-(4-bromanylphenoxy)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[4-(4-bromanylphenoxy)phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[4-(4-bromophenoxy)phenyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(4-bromophenoxy)phenyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[4-(4-bromophenoxy)phenyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[4-(4-bromophenoxy)phenyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C22H16BrN3O3 MolecularWeight: 450.28474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)OC4=CC=C(C=C4)Br

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H16BrN3O3/c1-26-22(28)19-5-3-2-4-18(19)20(25-26)21(27)24-15-8-12-17(13-9-15)29-16-10-6-14(23)7-11-16/h2-13H,1H3,(H,24,27)