[4-[1-acetyloxy-2-(tert-butylamino)ethyl]-2-oxidanyl-phenyl] 4-methoxybenzoate

Systemtic Name: [4-[1-acetyloxy-2-(tert-butylamino)ethyl]-2-oxidanyl-phenyl] 4-methoxybenzoate Openeye Name: [4-[1-acetoxy-2-(tert-butylamino)ethyl]-2-hydroxy-phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [4-[1-acetyloxy-2-(tert-butylamino)ethyl]-2-hydroxyphenyl] ester IUPAC Name: [4-[1-acetyloxy-2-(tert-butylamino)ethyl]-2-hydroxyphenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [4-[1-acetoxy-2-(tert-butylamino)ethyl]-2-hydroxy-phenyl] ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO6/c1-14(24)28-20(13-23-22(2,3)4)16-8-11-19(18(25)12-16)29-21(26)15-6-9-17(27-5)10-7-15/h6-12,20,23,25H,13H2,1-5H3