[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 3-(4-morpholin-4-ylsulfonylphenyl)propanoate

Systemtic Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 3-(4-morpholin-4-ylsulfonylphenyl)propanoate Openeye Name: [5-(2-furyl)isoxazol-3-yl]methyl 3-(4-morpholinosulfonylphenyl)propanoate CAS Name: 3-[4-(4-morpholinylsulfonyl)phenyl]propanoic acid [5-(2-furanyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 3-(4-morpholin-4-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-morpholinosulfonylphenyl)propionic acid [5-(2-furyl)isoxazol-3-yl]methyl ester Formula: C21H22N2O7S MolecularWeight: 446.47358

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCC3=NOC(=C3)C4=CC=CO4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CCC(=O)OCC3=NOC(=C3)C4=CC=CO4

InChI

InChI=1S/C21H22N2O7S/c24-21(29-15-17-14-20(30-22-17)19-2-1-11-28-19)8-5-16-3-6-18(7-4-16)31(25,26)23-9-12-27-13-10-23/h1-4,6-7,11,14H,5,8-10,12-13,15H2