[2-chloranyl-6-ethoxy-4-[(E)-(pyridin-4-ylcarbonylhydrazinylidene)methyl]phenyl] methanesulfonate

Systemtic Name: [2-chloranyl-6-ethoxy-4-[(E)-(pyridin-4-ylcarbonylhydrazinylidene)methyl]phenyl] methanesulfonate Openeye Name: [2-chloro-6-ethoxy-4-[(E)-(pyridine-4-carbonylhydrazono)methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-chloro-6-ethoxy-4-[(E)-[[oxo(pyridin-4-yl)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-chloro-6-ethoxy-4-[(E)-(pyridine-4-carbonylhydrazinylidene)methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-chloro-6-ethoxy-4-[(E)-(isonicotinoylhydrazono)methyl]phenyl] ester Formula: C16H16ClN3O5S MolecularWeight: 397.83334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)C2=CC=NC=C2)Cl)OS(=O)(=O)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=N/NC(=O)C2=CC=NC=C2)Cl)OS(=O)(=O)C

InChI

InChI=1S/C16H16ClN3O5S/c1-3-24-14-9-11(8-13(17)15(14)25-26(2,22)23)10-19-20-16(21)12-4-6-18-7-5-12/h4-10H,3H2,1-2H3,(H,20,21)/b19-10+