(6E)-6-(aminocarbonylhydrazinylidene)-6-[5-(carboxymethyl)thiophen-2-yl]hexanoic acid

Systemtic Name: (6E)-6-(aminocarbonylhydrazinylidene)-6-[5-(carboxymethyl)thiophen-2-yl]hexanoic acid Openeye Name: (6E)-6-(carbamoylhydrazono)-6-[5-(carboxymethyl)-2-thienyl]hexanoic acid CAS Name: (6E)-6-(carbamoylhydrazinylidene)-6-[5-(carboxymethyl)-2-thiophenyl]hexanoic acid IUPAC Name: (6E)-6-(carbamoylhydrazinylidene)-6-[5-(carboxymethyl)thiophen-2-yl]hexanoic acid Traditional Name: (6E)-6-[5-(carboxymethyl)-2-thienyl]-6-semicarbazono-hexanoic acid Formula: C13H17N3O5S MolecularWeight: 327.35618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)C(=NNC(=O)N)CCCCC(=O)O)CC(=O)O

Isomeric SMILES

C1=C(SC(=C1)/C(=N/NC(=O)N)/CCCCC(=O)O)CC(=O)O

InChI

InChI=1S/C13H17N3O5S/c14-13(21)16-15-9(3-1-2-4-11(17)18)10-6-5-8(22-10)7-12(19)20/h5-6H,1-4,7H2,(H,17,18)(H,19,20)(H3,14,16,21)/b15-9+