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

Systemtic Name: [2-methoxy-4-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazinylidene)methyl]phenyl] ethanoate Openeye Name: [2-methoxy-4-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazono)methyl]phenyl] acetate CAS Name: acetic acid [2-methoxy-4-[(Z)-[[[2-(4-morpholin-4-iumyl)ethylamino]-sulfanylidenemethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(Z)-(2-morpholin-4-ium-4-ylethylcarbamothioylhydrazinylidene)methyl]phenyl] acetate Traditional Name: acetic acid [2-methoxy-4-[(Z)-(2-morpholin-4-ium-4-ylethylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C17H25N4O4S+ MolecularWeight: 381.4698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=NNC(=S)NCC[NH+]2CCOCC2)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)/C=N\NC(=S)NCC[NH+]2CCOCC2)OC

InChI

InChI=1S/C17H24N4O4S/c1-13(22)25-15-4-3-14(11-16(15)23-2)12-19-20-17(26)18-5-6-21-7-9-24-10-8-21/h3-4,11-12H,5-10H2,1-2H3,(H2,18,20,26)/p+1/b19-12-