[4-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate Openeye Name: [4-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[[1-oxo-3-(2-oxo-1,3-benzoxazol-3-yl)propyl]amino]-1-pyrazolyl]methyl ester IUPAC Name: [4-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoylamino]pyrazol-1-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[3-(2-keto-1,3-benzoxazol-3-yl)propanoylamino]pyrazol-1-yl]methyl ester Formula: C19H22N4O5 MolecularWeight: 386.40178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=C(C=N1)NC(=O)CCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=C(C=N1)NC(=O)CCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C19H22N4O5/c1-19(2,3)17(25)27-12-22-11-13(10-20-22)21-16(24)8-9-23-14-6-4-5-7-15(14)28-18(23)26/h4-7,10-11H,8-9,12H2,1-3H3,(H,21,24)