[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 2,3-dimethoxy-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 2,3-dimethoxy-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 2,3-dimethoxy-5-morpholinosulfonyl-benzoate CAS Name: 2,3-dimethoxy-5-(4-morpholinylsulfonyl)benzoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2,3-dimethoxy-5-morpholinosulfonyl-benzoic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C20H24N2O9S MolecularWeight: 468.47756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC(=O)NCC3=CC=CO3)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC(=O)NCC3=CC=CO3)OC

InChI

InChI=1S/C20H24N2O9S/c1-27-17-11-15(32(25,26)22-5-8-29-9-6-22)10-16(19(17)28-2)20(24)31-13-18(23)21-12-14-4-3-7-30-14/h3-4,7,10-11H,5-6,8-9,12-13H2,1-2H3,(H,21,23)