(5-ethanoyl-2-ethoxy-phenyl)methyl 2-chloranyl-5-sulfamoyl-benzoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 2-chloranyl-5-sulfamoyl-benzoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 2-chloro-5-sulfamoyl-benzoate CAS Name: 2-chloro-5-sulfamoylbenzoic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 2-chloro-5-sulfamoylbenzoate Traditional Name: 2-chloro-5-sulfamoyl-benzoic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C18H18ClNO6S MolecularWeight: 411.85662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Cl

InChI

InChI=1S/C18H18ClNO6S/c1-3-25-17-7-4-12(11(2)21)8-13(17)10-26-18(22)15-9-14(27(20,23)24)5-6-16(15)19/h4-9H,3,10H2,1-2H3,(H2,20,23,24)