2-[2-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanoate

Systemtic Name: 2-[2-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazinylidene)methyl]phenoxy]ethanoate Openeye Name: 2-[2-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazono)methyl]phenoxy]acetate CAS Name: 2-[2-[(Z)-[[[2-(4-morpholin-4-iumyl)ethylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]acetate IUPAC Name: 2-[2-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazinylidene)methyl]phenoxy]acetate Traditional Name: 2-[2-[(Z)-(2-morpholin-4-ium-4-ylethylthiocarbamoylhydrazono)methyl]phenoxy]acetate Formula: C16H22N4O4S MolecularWeight: 366.43528

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=S)NN=CC2=CC=CC=C2OCC(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCNC(=S)N/N=C\C2=CC=CC=C2OCC(=O)[O-]

InChI

InChI=1S/C16H22N4O4S/c21-15(22)12-24-14-4-2-1-3-13(14)11-18-19-16(25)17-5-6-20-7-9-23-10-8-20/h1-4,11H,5-10,12H2,(H,21,22)(H2,17,19,25)/b18-11-