N-(2-bromophenyl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-(2-bromophenyl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-(2-bromophenyl)-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-(2-bromophenyl)-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-(2-bromophenyl)-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-(2-bromophenyl)-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C21H14BrN3O2 MolecularWeight: 420.25876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=CC=C4Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C21H14BrN3O2/c22-17-12-6-7-13-18(17)23-20(26)19-15-10-4-5-11-16(15)21(27)25(24-19)14-8-2-1-3-9-14/h1-13H,(H,23,26)