4-[4-[(2-chloranyl-1,3-thiazol-5-yl)methoxy]phenyl]sulfonyl-3-methyl-morpholine-3-carboxylic acid

Systemtic Name: 4-[4-[(2-chloranyl-1,3-thiazol-5-yl)methoxy]phenyl]sulfonyl-3-methyl-morpholine-3-carboxylic acid Openeye Name: 4-[4-[(2-chlorothiazol-5-yl)methoxy]phenyl]sulfonyl-3-methyl-morpholine-3-carboxylic acid CAS Name: 4-[4-[(2-chloro-5-thiazolyl)methoxy]phenyl]sulfonyl-3-methyl-3-morpholinecarboxylic acid IUPAC Name: 4-[4-[(2-chloro-1,3-thiazol-5-yl)methoxy]phenyl]sulfonyl-3-methylmorpholine-3-carboxylic acid Traditional Name: 4-[4-[(2-chlorothiazol-5-yl)methoxy]phenyl]sulfonyl-3-methyl-morpholine-3-carboxylic acid Formula: C16H17ClN2O6S2 MolecularWeight: 432.89898

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COCCN1S(=O)(=O)C2=CC=C(C=C2)OCC3=CN=C(S3)Cl)C(=O)O

Isomeric SMILES

CC1(COCCN1S(=O)(=O)C2=CC=C(C=C2)OCC3=CN=C(S3)Cl)C(=O)O

InChI

InChI=1S/C16H17ClN2O6S2/c1-16(14(20)21)10-24-7-6-19(16)27(22,23)13-4-2-11(3-5-13)25-9-12-8-18-15(17)26-12/h2-5,8H,6-7,9-10H2,1H3,(H,20,21)