(4-bromanyl-2-chloranyl-6-methyl-phenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (4-bromanyl-2-chloranyl-6-methyl-phenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (4-bromo-2-chloro-6-methyl-phenyl) 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid (4-bromo-2-chloro-6-methylphenyl) ester IUPAC Name: (4-bromo-2-chloro-6-methylphenyl) 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid (4-bromo-2-chloro-6-methyl-phenyl) ester Formula: C17H12BrClN2O3 MolecularWeight: 407.64578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)Cl)Br

InChI

InChI=1S/C17H12BrClN2O3/c1-9-7-10(18)8-13(19)15(9)24-17(23)14-11-5-3-4-6-12(11)16(22)21(2)20-14/h3-8H,1-2H3