[4-[2-(tert-butylamino)ethanoyl]-2-(2,2-dimethylpropanoyloxymethyl)phenyl] 3-methylbenzoate

Systemtic Name: [4-[2-(tert-butylamino)ethanoyl]-2-(2,2-dimethylpropanoyloxymethyl)phenyl] 3-methylbenzoate Openeye Name: [4-[2-(tert-butylamino)acetyl]-2-(2,2-dimethylpropanoyloxymethyl)phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-[2-(tert-butylamino)-1-oxoethyl]-2-[(2,2-dimethyl-1-oxopropoxy)methyl]phenyl] ester IUPAC Name: [4-[2-(tert-butylamino)acetyl]-2-(2,2-dimethylpropanoyloxymethyl)phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [4-[2-(tert-butylamino)acetyl]-2-(pivaloyloxymethyl)phenyl] ester Formula: C26H33NO5 MolecularWeight: 439.54392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)C(=O)CNC(C)(C)C)COC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)C(=O)CNC(C)(C)C)COC(=O)C(C)(C)C

InChI

InChI=1S/C26H33NO5/c1-17-9-8-10-19(13-17)23(29)32-22-12-11-18(21(28)15-27-26(5,6)7)14-20(22)16-31-24(30)25(2,3)4/h8-14,27H,15-16H2,1-7H3