[2-[2-(2-bromophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: [2-[2-(2-bromophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: [2-[2-(2-bromobenzoyl)hydrazino]-2-oxo-ethyl] 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid [2-[[(2-bromophenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-bromobenzoyl)hydrazinyl]-2-oxoethyl] 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid [2-[N'-(2-bromobenzoyl)hydrazino]-2-keto-ethyl] ester Formula: C18H13BrN4O5 MolecularWeight: 445.22362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OCC(=O)NNC(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)OCC(=O)NNC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C18H13BrN4O5/c19-13-8-4-3-7-12(13)17(26)22-20-14(24)9-28-18(27)15-10-5-1-2-6-11(10)16(25)23-21-15/h1-8H,9H2,(H,20,24)(H,22,26)(H,23,25)