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

Systemtic Name: [4-[2-(tert-butylamino)ethanoyl]-2-(3-methylbutanoyloxy)phenyl] 4-methylbenzoate Openeye Name: [4-[2-(tert-butylamino)acetyl]-2-(3-methylbutanoyloxy)phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[2-(tert-butylamino)-1-oxoethyl]-2-(3-methyl-1-oxobutoxy)phenyl] ester IUPAC Name: [4-[2-(tert-butylamino)acetyl]-2-(3-methylbutanoyloxy)phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[2-(tert-butylamino)acetyl]-2-isovaleryloxy-phenyl] ester Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31NO5/c1-16(2)13-23(28)30-22-14-19(20(27)15-26-25(4,5)6)11-12-21(22)31-24(29)18-9-7-17(3)8-10-18/h7-12,14,16,26H,13,15H2,1-6H3