ethyl 4-[2-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylhydrazinyl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[2-(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylhydrazinyl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[2-(3-bromo-4-ethoxy-5-methoxy-benzoyl)hydrazino]-4-oxo-butanoate CAS Name: 4-[[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethyl]hydrazo]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-bromo-4-ethoxy-5-methoxybenzoyl)hydrazinyl]-4-oxobutanoate Traditional Name: 4-[N'-(3-bromo-4-ethoxy-5-methoxy-benzoyl)hydrazino]-4-keto-butyric acid ethyl ester Formula: C16H21BrN2O6 MolecularWeight: 417.25174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NNC(=O)CCC(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NNC(=O)CCC(=O)OCC)OC

InChI

InChI=1S/C16H21BrN2O6/c1-4-24-14(21)7-6-13(20)18-19-16(22)10-8-11(17)15(25-5-2)12(9-10)23-3/h8-9H,4-7H2,1-3H3,(H,18,20)(H,19,22)