ethyl 4-[3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanoylamino]benzoate

Systemtic Name: ethyl 4-[3-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanoylamino]benzoate Openeye Name: ethyl 4-[3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanoylamino]benzoate CAS Name: 4-[[1-oxo-3-[2-oxo-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-3-yl]propyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)propanoylamino]benzoate Traditional Name: 4-[3-(2-keto-6-pyrrolidinosulfonyl-1,3-benzoxazol-3-yl)propanoylamino]benzoic acid ethyl ester Formula: C23H25N3O7S MolecularWeight: 487.5255

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)OC2=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)OC2=O

InChI

InChI=1S/C23H25N3O7S/c1-2-32-22(28)16-5-7-17(8-6-16)24-21(27)11-14-26-19-10-9-18(15-20(19)33-23(26)29)34(30,31)25-12-3-4-13-25/h5-10,15H,2-4,11-14H2,1H3,(H,24,27)