(3-bromophenyl)methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (3-bromophenyl)methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (3-bromophenyl)methyl 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid (3-bromophenyl)methyl ester IUPAC Name: (3-bromophenyl)methyl 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid (3-bromobenzyl) ester Formula: C18H15BrN2O3 MolecularWeight: 387.2273

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC(=CC=C3)Br

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC(=CC=C3)Br

InChI

InChI=1S/C18H15BrN2O3/c1-2-21-17(22)15-9-4-3-8-14(15)16(20-21)18(23)24-11-12-6-5-7-13(19)10-12/h3-10H,2,11H2,1H3