ethanedioic acid; 1-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]pyrrolidine

Systemtic Name: ethanedioic acid; 1-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]pyrrolidine Openeye Name: 1-[4-[4-(1,1-dimethylpropyl)phenoxy]butyl]pyrrolidine; oxalic acid CAS Name: 1-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]pyrrolidine; oxalic acid IUPAC Name: 1-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]pyrrolidine; oxalic acid Traditional Name: 1-[4-(4-tert-amylphenoxy)butyl]pyrrolidine; oxalic acid Formula: C21H33NO5 MolecularWeight: 379.49042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCCCCN2CCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCCCCN2CCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H31NO.C2H2O4/c1-4-19(2,3)17-9-11-18(12-10-17)21-16-8-7-15-20-13-5-6-14-20;3-1(4)2(5)6/h9-12H,4-8,13-16H2,1-3H3;(H,3,4)(H,5,6)