4-(4-acetamidophenyl)sulfonyloxy-3-chloranyl-5-methoxy-benzoic acid

Systemtic Name: 4-(4-acetamidophenyl)sulfonyloxy-3-chloranyl-5-methoxy-benzoic acid Openeye Name: 4-(4-acetamidophenyl)sulfonyloxy-3-chloro-5-methoxy-benzoic acid CAS Name: 4-(4-acetamidophenyl)sulfonyloxy-3-chloro-5-methoxybenzoic acid IUPAC Name: 4-(4-acetamidophenyl)sulfonyloxy-3-chloro-5-methoxybenzoic acid Traditional Name: 4-(4-acetamidophenyl)sulfonyloxy-3-chloro-5-methoxy-benzoic acid Formula: C16H14ClNO7S MolecularWeight: 399.80286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC

InChI

InChI=1S/C16H14ClNO7S/c1-9(19)18-11-3-5-12(6-4-11)26(22,23)25-15-13(17)7-10(16(20)21)8-14(15)24-2/h3-8H,1-2H3,(H,18,19)(H,20,21)