4-(2-methoxyethylsulfanyl)-3-morpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 4-(2-methoxyethylsulfanyl)-3-morpholin-4-ylsulfonyl-benzoic acid Openeye Name: 4-(2-methoxyethylsulfanyl)-3-morpholinosulfonyl-benzoic acid CAS Name: 4-(2-methoxyethylthio)-3-(4-morpholinylsulfonyl)benzoic acid IUPAC Name: 4-(2-methoxyethylsulfanyl)-3-morpholin-4-ylsulfonylbenzoic acid Traditional Name: 4-(2-methoxyethylthio)-3-morpholinosulfonyl-benzoic acid Formula: C14H19NO6S2 MolecularWeight: 361.43376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCSC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCOCC2

Isomeric SMILES

COCCSC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C14H19NO6S2/c1-20-8-9-22-12-3-2-11(14(16)17)10-13(12)23(18,19)15-4-6-21-7-5-15/h2-3,10H,4-9H2,1H3,(H,16,17)