(E)-4-[2-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoyl]hydrazinyl]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[2-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoyl]hydrazinyl]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]hydrazino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[2-(2-bromo-4-tert-butylphenoxy)-1-oxoethyl]hydrazo]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[2-[2-(2-bromo-4-tert-butylphenoxy)acetyl]hydrazinyl]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[N'-[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]hydrazino]-4-keto-but-2-enoic acid Formula: C16H19BrN2O5 MolecularWeight: 399.23646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=O)C=CC(=O)O)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=O)/C=C/C(=O)O)Br

InChI

InChI=1S/C16H19BrN2O5/c1-16(2,3)10-4-5-12(11(17)8-10)24-9-14(21)19-18-13(20)6-7-15(22)23/h4-8H,9H2,1-3H3,(H,18,20)(H,19,21)(H,22,23)/b7-6+