(2,5-dimethylphenyl)methyl 4-chloranyl-3-sulfamoyl-benzoate

Systemtic Name: (2,5-dimethylphenyl)methyl 4-chloranyl-3-sulfamoyl-benzoate Openeye Name: (2,5-dimethylphenyl)methyl 4-chloro-3-sulfamoyl-benzoate CAS Name: 4-chloro-3-sulfamoylbenzoic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 4-chloro-3-sulfamoylbenzoate Traditional Name: 4-chloro-3-sulfamoyl-benzoic acid (2,5-dimethylbenzyl) ester Formula: C16H16ClNO4S MolecularWeight: 353.82054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N

InChI

InChI=1S/C16H16ClNO4S/c1-10-3-4-11(2)13(7-10)9-22-16(19)12-5-6-14(17)15(8-12)23(18,20)21/h3-8H,9H2,1-2H3,(H2,18,20,21)