4-[[3-(2,2-dimethylbutanoyloxy)-2-oxidanyl-propyl]amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[3-(2,2-dimethylbutanoyloxy)-2-oxidanyl-propyl]amino]cyclohexane-1-carboxylic acid Openeye Name: 4-[[3-(2,2-dimethylbutanoyloxy)-2-hydroxy-propyl]amino]cyclohexanecarboxylic acid CAS Name: 4-[[3-(2,2-dimethyl-1-oxobutoxy)-2-hydroxypropyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[3-(2,2-dimethylbutanoyloxy)-2-hydroxypropyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[[3-(2,2-dimethylbutanoyloxy)-2-hydroxy-propyl]amino]cyclohexanecarboxylic acid Formula: C16H29NO5 MolecularWeight: 315.40516

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OCC(CNC1CCC(CC1)C(=O)O)O

Isomeric SMILES

CCC(C)(C)C(=O)OCC(CNC1CCC(CC1)C(=O)O)O

InChI

InChI=1S/C16H29NO5/c1-4-16(2,3)15(21)22-10-13(18)9-17-12-7-5-11(6-8-12)14(19)20/h11-13,17-18H,4-10H2,1-3H3,(H,19,20)