[2-methoxy-4-[(E)-(phenylsulfonylhydrazinylidene)methyl]phenyl] 3-bromanylbenzoate

Systemtic Name: [2-methoxy-4-[(E)-(phenylsulfonylhydrazinylidene)methyl]phenyl] 3-bromanylbenzoate Openeye Name: [4-[(E)-(benzenesulfonylhydrazono)methyl]-2-methoxy-phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-[(E)-(benzenesulfonylhydrazinylidene)methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(benzenesulfonylhydrazinylidene)methyl]-2-methoxyphenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[(E)-(besylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C21H17BrN2O5S MolecularWeight: 489.33908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NS(=O)(=O)C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H17BrN2O5S/c1-28-20-12-15(14-23-24-30(26,27)18-8-3-2-4-9-18)10-11-19(20)29-21(25)16-6-5-7-17(22)13-16/h2-14,24H,1H3/b23-14+