[4-[(E)-[(4-bromophenyl)sulfonylhydrazinylidene]methyl]-2-methoxy-phenyl] 2-chloranylbenzoate

Systemtic Name: [4-[(E)-[(4-bromophenyl)sulfonylhydrazinylidene]methyl]-2-methoxy-phenyl] 2-chloranylbenzoate Openeye Name: [4-[(E)-[(4-bromophenyl)sulfonylhydrazono]methyl]-2-methoxy-phenyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [4-[(E)-[(4-bromophenyl)sulfonylhydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[(4-bromophenyl)sulfonylhydrazinylidene]methyl]-2-methoxyphenyl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [4-[(E)-(brosylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C21H16BrClN2O5S MolecularWeight: 523.78414

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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=CC=CC=C3Cl

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NS(=O)(=O)C2=CC=C(C=C2)Br)OC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C21H16BrClN2O5S/c1-29-20-12-14(13-24-25-31(27,28)16-9-7-15(22)8-10-16)6-11-19(20)30-21(26)17-4-2-3-5-18(17)23/h2-13,25H,1H3/b24-13+