ethyl 2-[2-oxidanylidene-6-(3-phenylpropylsulfamoyl)-1,3-benzoxazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-oxidanylidene-6-(3-phenylpropylsulfamoyl)-1,3-benzoxazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-oxo-6-(3-phenylpropylsulfamoyl)-1,3-benzoxazol-3-yl]acetate CAS Name: 2-[2-oxo-6-(3-phenylpropylsulfamoyl)-1,3-benzoxazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-oxo-6-(3-phenylpropylsulfamoyl)-1,3-benzoxazol-3-yl]acetate Traditional Name: 2-[2-keto-6-(3-phenylpropylsulfamoyl)-1,3-benzoxazol-3-yl]acetic acid ethyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)NCCCC3=CC=CC=C3)OC1=O

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)NCCCC3=CC=CC=C3)OC1=O

InChI

InChI=1S/C20H22N2O6S/c1-2-27-19(23)14-22-17-11-10-16(13-18(17)28-20(22)24)29(25,26)21-12-6-9-15-7-4-3-5-8-15/h3-5,7-8,10-11,13,21H,2,6,9,12,14H2,1H3