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

Systemtic Name: ethyl 3-[2-(2-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)acetyl]amino]benzoate CAS Name: 3-[[1-oxo-2-[2-oxo-6-(1-pyrrolidinylsulfonyl)-1,3-benzoxazol-3-yl]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2-oxo-6-pyrrolidin-1-ylsulfonyl-1,3-benzoxazol-3-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(2-keto-6-pyrrolidinosulfonyl-1,3-benzoxazol-3-yl)acetyl]amino]benzoic acid ethyl ester Formula: C22H23N3O7S MolecularWeight: 473.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)OC2=O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCC4)OC2=O

InChI

InChI=1S/C22H23N3O7S/c1-2-31-21(27)15-6-5-7-16(12-15)23-20(26)14-25-18-9-8-17(13-19(18)32-22(25)28)33(29,30)24-10-3-4-11-24/h5-9,12-13H,2-4,10-11,14H2,1H3,(H,23,26)