(4-bromanyl-2-chloranyl-phenyl) 2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoate Openeye Name: (4-bromo-2-chloro-phenyl) 2-(4-carbamoyl-1-oxo-phthalazin-2-yl)acetate CAS Name: 2-(4-carbamoyl-1-oxo-2-phthalazinyl)acetic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 2-(4-carbamoyl-1-oxophthalazin-2-yl)acetate Traditional Name: 2-(4-carbamoyl-1-keto-phthalazin-2-yl)acetic acid (4-bromo-2-chloro-phenyl) ester Formula: C17H11BrClN3O4 MolecularWeight: 436.64394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)OC3=C(C=C(C=C3)Br)Cl)C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)OC3=C(C=C(C=C3)Br)Cl)C(=O)N

InChI

InChI=1S/C17H11BrClN3O4/c18-9-5-6-13(12(19)7-9)26-14(23)8-22-17(25)11-4-2-1-3-10(11)15(21-22)16(20)24/h1-7H,8H2,(H2,20,24)