[2-methoxy-5-[(phenylsulfonyldiazenyl)methyl]phenyl] benzoate

Systemtic Name: [2-methoxy-5-[(phenylsulfonyldiazenyl)methyl]phenyl] benzoate Openeye Name: [5-(benzenesulfonylazomethyl)-2-methoxy-phenyl] benzoate CAS Name: benzoic acid [5-(benzenesulfonylazomethyl)-2-methoxyphenyl] ester IUPAC Name: [5-[(benzenesulfonyldiazenyl)methyl]-2-methoxyphenyl] benzoate Traditional Name: benzoic acid [5-(besylazomethyl)-2-methoxy-phenyl] ester Formula: C21H18N2O5S MolecularWeight: 410.44302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O5S/c1-27-19-13-12-16(14-20(19)28-21(24)17-8-4-2-5-9-17)15-22-23-29(25,26)18-10-6-3-7-11-18/h2-14H,15H2,1H3