[2-methoxy-4-[(E)-(2-thiophen-2-ylethanoylhydrazinylidene)methyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-methoxy-4-[(E)-(2-thiophen-2-ylethanoylhydrazinylidene)methyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-methoxy-4-[(E)-[[2-(2-thienyl)acetyl]hydrazono]methyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-methoxy-4-[(E)-[(1-oxo-2-thiophen-2-ylethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(2-thiophen-2-ylacetyl)hydrazinylidene]methyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-methoxy-4-[(E)-[[2-(2-thienyl)acetyl]hydrazono]methyl]phenyl] ester Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=O)CC3=CC=CS3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)/C=N/NC(=O)CC3=CC=CS3)OC

InChI

InChI=1S/C21H20N2O5S2/c1-15-5-8-18(9-6-15)30(25,26)28-19-10-7-16(12-20(19)27-2)14-22-23-21(24)13-17-4-3-11-29-17/h3-12,14H,13H2,1-2H3,(H,23,24)/b22-14+