(4-bromophenyl)methyl 2-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]ethanoate

Systemtic Name: (4-bromophenyl)methyl 2-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]ethanoate Openeye Name: (4-bromophenyl)methyl 2-(3,6-dioxo-1H-pyridazin-2-yl)acetate CAS Name: 2-(3,6-dioxo-1H-pyridazin-2-yl)acetic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-(3,6-dioxo-1H-pyridazin-2-yl)acetate Traditional Name: 2-(3,6-diketo-1H-pyridazin-2-yl)acetic acid (4-bromobenzyl) ester Formula: C13H11BrN2O4 MolecularWeight: 339.14144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CN2C(=O)C=CC(=O)N2)Br

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CN2C(=O)C=CC(=O)N2)Br

InChI

InChI=1S/C13H11BrN2O4/c14-10-3-1-9(2-4-10)8-20-13(19)7-16-12(18)6-5-11(17)15-16/h1-6H,7-8H2,(H,15,17)