(4-bromanyl-2-chloranyl-6-methyl-phenyl) 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: (4-bromanyl-2-chloranyl-6-methyl-phenyl) 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: (4-bromo-2-chloro-6-methyl-phenyl) 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid (4-bromo-2-chloro-6-methylphenyl) ester IUPAC Name: (4-bromo-2-chloro-6-methylphenyl) 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic 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)CC2=NNC(=O)C3=CC=CC=C32)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)CC2=NNC(=O)C3=CC=CC=C32)Cl)Br

InChI

InChI=1S/C17H12BrClN2O3/c1-9-6-10(18)7-13(19)16(9)24-15(22)8-14-11-4-2-3-5-12(11)17(23)21-20-14/h2-7H,8H2,1H3,(H,21,23)