(2-bromophenyl)methyl 3-(2-hydroxyethyl)-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (2-bromophenyl)methyl 3-(2-hydroxyethyl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (2-bromophenyl)methyl 3-(2-hydroxyethyl)-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(2-hydroxyethyl)-4-oxo-1-phthalazinecarboxylic acid (2-bromophenyl)methyl ester IUPAC Name: (2-bromophenyl)methyl 3-(2-hydroxyethyl)-4-oxophthalazine-1-carboxylate Traditional Name: 3-(2-hydroxyethyl)-4-keto-phthalazine-1-carboxylic acid (2-bromobenzyl) ester Formula: C18H15BrN2O4 MolecularWeight: 403.2267

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=NN(C(=O)C3=CC=CC=C32)CCO)Br

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=NN(C(=O)C3=CC=CC=C32)CCO)Br

InChI

InChI=1S/C18H15BrN2O4/c19-15-8-4-1-5-12(15)11-25-18(24)16-13-6-2-3-7-14(13)17(23)21(20-16)9-10-22/h1-8,22H,9-11H2