2-chloranyl-3-(2-methoxyethylamino)-4-methylsulfonyl-benzoic acid

Systemtic Name: 2-chloranyl-3-(2-methoxyethylamino)-4-methylsulfonyl-benzoic acid Openeye Name: 2-chloro-3-(2-methoxyethylamino)-4-methylsulfonyl-benzoic acid CAS Name: 2-chloro-3-(2-methoxyethylamino)-4-methylsulfonylbenzoic acid IUPAC Name: 2-chloro-3-(2-methoxyethylamino)-4-methylsulfonylbenzoic acid Traditional Name: 2-chloro-4-mesyl-3-(2-methoxyethylamino)benzoic acid Formula: C11H14ClNO5S MolecularWeight: 307.75056

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=CC(=C1Cl)C(=O)O)S(=O)(=O)C

Isomeric SMILES

COCCNC1=C(C=CC(=C1Cl)C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C11H14ClNO5S/c1-18-6-5-13-10-8(19(2,16)17)4-3-7(9(10)12)11(14)15/h3-4,13H,5-6H2,1-2H3,(H,14,15)