N-(2-bromanyl-4-methyl-phenyl)-3-(4-ethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-(4-ethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-3-(4-ethoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-3-(4-ethoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-3-(4-ethoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-4-keto-3-p-phenetyl-phthalazine-1-carboxamide Formula: C24H20BrN3O3 MolecularWeight: 478.3379

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=C(C=C(C=C4)C)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=C(C=C(C=C4)C)Br

InChI

InChI=1S/C24H20BrN3O3/c1-3-31-17-11-9-16(10-12-17)28-24(30)19-7-5-4-6-18(19)22(27-28)23(29)26-21-13-8-15(2)14-20(21)25/h4-14H,3H2,1-2H3,(H,26,29)