[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: [2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: [2-(3-bromo-4-methoxy-phenyl)-2-oxo-ethyl] 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromo-4-methoxyphenyl)-2-oxoethyl] 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid [2-(3-bromo-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C18H13BrN2O5 MolecularWeight: 417.21022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC(=O)C2=NNC(=O)C3=CC=CC=C32)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC(=O)C2=NNC(=O)C3=CC=CC=C32)Br

InChI

InChI=1S/C18H13BrN2O5/c1-25-15-7-6-10(8-13(15)19)14(22)9-26-18(24)16-11-4-2-3-5-12(11)17(23)21-20-16/h2-8H,9H2,1H3,(H,21,23)