[3-[2-(tert-butylamino)-1-oxidanyl-ethyl]-5-[4-(2,2-dimethylpropanoyloxy)phenyl]carbonyloxy-phenyl] 4-(2,2-dimethylpropanoyloxy)benzoate

Systemtic Name: [3-[2-(tert-butylamino)-1-oxidanyl-ethyl]-5-[4-(2,2-dimethylpropanoyloxy)phenyl]carbonyloxy-phenyl] 4-(2,2-dimethylpropanoyloxy)benzoate Openeye Name: [3-[2-(tert-butylamino)-1-hydroxy-ethyl]-5-[4-(2,2-dimethylpropanoyloxy)benzoyl]oxy-phenyl] 4-(2,2-dimethylpropanoyloxy)benzoate CAS Name: 4-(2,2-dimethyl-1-oxopropoxy)benzoic acid [3-[2-(tert-butylamino)-1-hydroxyethyl]-5-[[4-(2,2-dimethyl-1-oxopropoxy)phenyl]-oxomethoxy]phenyl] ester IUPAC Name: [3-[2-(tert-butylamino)-1-hydroxyethyl]-5-[4-(2,2-dimethylpropanoyloxy)benzoyl]oxyphenyl] 4-(2,2-dimethylpropanoyloxy)benzoate Traditional Name: 4-pivaloyloxybenzoic acid [3-[2-(tert-butylamino)-1-hydroxy-ethyl]-5-(4-pivaloyloxybenzoyl)oxy-phenyl] ester Formula: C36H43NO9 MolecularWeight: 633.72792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC=C(C=C1)C(=O)OC2=CC(=CC(=C2)C(CNC(C)(C)C)O)OC(=O)C3=CC=C(C=C3)OC(=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC=C(C=C1)C(=O)OC2=CC(=CC(=C2)C(CNC(C)(C)C)O)OC(=O)C3=CC=C(C=C3)OC(=O)C(C)(C)C

InChI

InChI=1S/C36H43NO9/c1-34(2,3)32(41)45-25-14-10-22(11-15-25)30(39)43-27-18-24(29(38)21-37-36(7,8)9)19-28(20-27)44-31(40)23-12-16-26(17-13-23)46-33(42)35(4,5)6/h10-20,29,37-38H,21H2,1-9H3