7-[(2E)-2-[(4-bromanylthiophen-2-yl)methylidene]hydrazinyl]-7-oxidanylidene-heptanoic acid

Systemtic Name: 7-[(2E)-2-[(4-bromanylthiophen-2-yl)methylidene]hydrazinyl]-7-oxidanylidene-heptanoic acid Openeye Name: 7-[(2E)-2-[(4-bromo-2-thienyl)methylene]hydrazino]-7-oxo-heptanoic acid CAS Name: 7-[(2E)-2-[(4-bromo-2-thiophenyl)methylidene]hydrazinyl]-7-oxoheptanoic acid IUPAC Name: 7-[(2E)-2-[(4-bromothiophen-2-yl)methylidene]hydrazinyl]-7-oxoheptanoic acid Traditional Name: 7-[(N'E)-N'-[(4-bromo-2-thienyl)methylene]hydrazino]-7-keto-enanthic acid Formula: C12H15BrN2O3S MolecularWeight: 347.2281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC=C1Br)C=NNC(=O)CCCCCC(=O)O

Isomeric SMILES

C1=C(SC=C1Br)/C=N/NC(=O)CCCCCC(=O)O

InChI

InChI=1S/C12H15BrN2O3S/c13-9-6-10(19-8-9)7-14-15-11(16)4-2-1-3-5-12(17)18/h6-8H,1-5H2,(H,15,16)(H,17,18)/b14-7+