4-chloranyl-3-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid

Systemtic Name: 4-chloranyl-3-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid Openeye Name: 4-chloro-3-(3-methylmorpholin-4-yl)sulfonyl-benzoic acid CAS Name: 4-chloro-3-[(3-methyl-4-morpholinyl)sulfonyl]benzoic acid IUPAC Name: 4-chloro-3-(3-methylmorpholin-4-yl)sulfonylbenzoic acid Traditional Name: 4-chloro-3-(3-methylmorpholino)sulfonyl-benzoic acid Formula: C12H14ClNO5S MolecularWeight: 319.76126

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

CC1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C12H14ClNO5S/c1-8-7-19-5-4-14(8)20(17,18)11-6-9(12(15)16)2-3-10(11)13/h2-3,6,8H,4-5,7H2,1H3,(H,15,16)