[3-methanoyl-5-methyl-2-oxidanyl-2-(phenylmethoxycarbamoyl)hexyl] 2,2-dimethylpropanoate

Systemtic Name: [3-methanoyl-5-methyl-2-oxidanyl-2-(phenylmethoxycarbamoyl)hexyl] 2,2-dimethylpropanoate Openeye Name: [2-(benzyloxycarbamoyl)-3-formyl-2-hydroxy-5-methyl-hexyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-formyl-2-hydroxy-5-methyl-2-[oxo-(phenylmethoxyamino)methyl]hexyl] ester IUPAC Name: [3-formyl-2-hydroxy-5-methyl-2-(phenylmethoxycarbamoyl)hexyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-(benzoxycarbamoyl)-3-formyl-2-hydroxy-5-methyl-hexyl] ester Formula: C21H31NO6 MolecularWeight: 393.47394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=O)C(COC(=O)C(C)(C)C)(C(=O)NOCC1=CC=CC=C1)O

Isomeric SMILES

CC(C)CC(C=O)C(COC(=O)C(C)(C)C)(C(=O)NOCC1=CC=CC=C1)O

InChI

InChI=1S/C21H31NO6/c1-15(2)11-17(12-23)21(26,14-27-19(25)20(3,4)5)18(24)22-28-13-16-9-7-6-8-10-16/h6-10,12,15,17,26H,11,13-14H2,1-5H3,(H,22,24)