N-(2-bromanyl-4-methyl-phenyl)-3-(3,5-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-(3,5-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-3-(3,5-dimethoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-3-(3,5-dimethoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-3-(3,5-dimethoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-3-(3,5-dimethoxyphenyl)-4-keto-phthalazine-1-carboxamide Formula: C24H20BrN3O4 MolecularWeight: 494.3373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=CC(=C4)OC)OC)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=CC(=C4)OC)OC)Br

InChI

InChI=1S/C24H20BrN3O4/c1-14-8-9-21(20(25)10-14)26-23(29)22-18-6-4-5-7-19(18)24(30)28(27-22)15-11-16(31-2)13-17(12-15)32-3/h4-13H,1-3H3,(H,26,29)