2-[1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl]oxy-5-morpholin-4-ylsulfonyl-benzoic acid

Systemtic Name: 2-[1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl]oxy-5-morpholin-4-ylsulfonyl-benzoic acid Openeye Name: 2-[2-(2-methoxyethylamino)-1-methyl-2-oxo-ethoxy]-5-morpholinosulfonyl-benzoic acid CAS Name: 2-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]oxy-5-(4-morpholinylsulfonyl)benzoic acid IUPAC Name: 2-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]oxy-5-morpholin-4-ylsulfonylbenzoic acid Traditional Name: 2-[2-keto-2-(2-methoxyethylamino)-1-methyl-ethoxy]-5-morpholinosulfonyl-benzoic acid Formula: C17H24N2O8S MolecularWeight: 416.44606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCOC)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)O

Isomeric SMILES

CC(C(=O)NCCOC)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)O

InChI

InChI=1S/C17H24N2O8S/c1-12(16(20)18-5-8-25-2)27-15-4-3-13(11-14(15)17(21)22)28(23,24)19-6-9-26-10-7-19/h3-4,11-12H,5-10H2,1-2H3,(H,18,20)(H,21,22)