4-[4-(1,3-benzoxazol-2-yl)phenoxy]butanoyloxymethyl 2,2-dimethylpropanoate

Systemtic Name: 4-[4-(1,3-benzoxazol-2-yl)phenoxy]butanoyloxymethyl 2,2-dimethylpropanoate Openeye Name: 4-[4-(1,3-benzoxazol-2-yl)phenoxy]butanoyloxymethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[4-(1,3-benzoxazol-2-yl)phenoxy]-1-oxobutoxy]methyl ester IUPAC Name: 4-[4-(1,3-benzoxazol-2-yl)phenoxy]butanoyloxymethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 4-[4-(1,3-benzoxazol-2-yl)phenoxy]butanoyloxymethyl ester Formula: C23H25NO6 MolecularWeight: 411.4477

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCOC(=O)CCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(C)(C)C(=O)OCOC(=O)CCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C23H25NO6/c1-23(2,3)22(26)29-15-28-20(25)9-6-14-27-17-12-10-16(11-13-17)21-24-18-7-4-5-8-19(18)30-21/h4-5,7-8,10-13H,6,9,14-15H2,1-3H3