2-[2-[(Z)-(1,3-benzodioxol-5-ylmethylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanoate

Systemtic Name: 2-[2-[(Z)-(1,3-benzodioxol-5-ylmethylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanoate Openeye Name: 2-[2-[(Z)-(1,3-benzodioxol-5-ylmethylcarbamothioylhydrazono)methyl]phenoxy]acetate CAS Name: 2-[2-[(Z)-[[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]acetate IUPAC Name: 2-[2-[(Z)-(1,3-benzodioxol-5-ylmethylcarbamothioylhydrazinylidene)methyl]phenoxy]acetate Traditional Name: 2-[2-[(Z)-(piperonylthiocarbamoylhydrazono)methyl]phenoxy]acetate Formula: C18H16N3O5S- MolecularWeight: 386.40174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NN=CC3=CC=CC=C3OCC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)N/N=C\C3=CC=CC=C3OCC(=O)[O-]

InChI

InChI=1S/C18H17N3O5S/c22-17(23)10-24-14-4-2-1-3-13(14)9-20-21-18(27)19-8-12-5-6-15-16(7-12)26-11-25-15/h1-7,9H,8,10-11H2,(H,22,23)(H2,19,21,27)/p-1/b20-9-