1-[[2-methoxy-5-(2-methylbutan-2-yl)phenyl]methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[[2-methoxy-5-(2-methylbutan-2-yl)phenyl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[[5-(1,1-dimethylpropyl)-2-methoxy-phenyl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[2-methoxy-5-(2-methylbutan-2-yl)phenyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[[2-methoxy-5-(2-methylbutan-2-yl)phenyl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(5-tert-amyl-2-methoxy-benzyl)proline Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OC)CN2CCCC2C(=O)O

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OC)CN2CCCC2C(=O)O

InChI

InChI=1S/C18H27NO3/c1-5-18(2,3)14-8-9-16(22-4)13(11-14)12-19-10-6-7-15(19)17(20)21/h8-9,11,15H,5-7,10,12H2,1-4H3,(H,20,21)