[2-methoxy-4-[(E)-(thiophen-2-ylcarbonylhydrazinylidene)methyl]phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [2-methoxy-4-[(E)-(thiophen-2-ylcarbonylhydrazinylidene)methyl]phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [2-methoxy-4-[(E)-(thiophene-2-carbonylhydrazono)methyl]phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [2-methoxy-4-[(E)-[[oxo(thiophen-2-yl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(thiophene-2-carbonylhydrazinylidene)methyl]phenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [2-methoxy-4-[(E)-(2-thenoylhydrazono)methyl]phenyl] ester Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC(=O)C3=CC=CS3)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)/C=N/NC(=O)C3=CC=CS3)OC

InChI

InChI=1S/C21H20N2O5S2/c1-14-6-7-15(2)20(11-14)30(25,26)28-17-9-8-16(12-18(17)27-3)13-22-23-21(24)19-5-4-10-29-19/h4-13H,1-3H3,(H,23,24)/b22-13+