[4-[[(4-bromophenyl)sulfonylhydrazinylidene]methyl]-2-methoxy-phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[[(4-bromophenyl)sulfonylhydrazinylidene]methyl]-2-methoxy-phenyl] pyridine-3-carboxylate Openeye Name: [4-[[(4-bromophenyl)sulfonylhydrazono]methyl]-2-methoxy-phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[[(4-bromophenyl)sulfonylhydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[(4-bromophenyl)sulfonylhydrazinylidene]methyl]-2-methoxyphenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[(brosylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C20H16BrN3O5S MolecularWeight: 490.32714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNS(=O)(=O)C2=CC=C(C=C2)Br)OC(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C=NNS(=O)(=O)C2=CC=C(C=C2)Br)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H16BrN3O5S/c1-28-19-11-14(4-9-18(19)29-20(25)15-3-2-10-22-13-15)12-23-24-30(26,27)17-7-5-16(21)6-8-17/h2-13,24H,1H3