2-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazin-1-yl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazin-1-yl)phenoxy]ethanoic acid Openeye Name: 2-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazin-1-yl)phenoxy]acetic acid CAS Name: 2-[4-(4-tert-butylcyclohexyl)-3-(4-butyl-1-piperazinyl)phenoxy]acetic acid IUPAC Name: 2-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazin-1-yl)phenoxy]acetic acid Traditional Name: 2-[4-(4-tert-butylcyclohexyl)-3-(4-butylpiperazino)phenoxy]acetic acid Formula: C26H42N2O3 MolecularWeight: 430.62328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=CC(=C2)OCC(=O)O)C3CCC(CC3)C(C)(C)C

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=CC(=C2)OCC(=O)O)C3CCC(CC3)C(C)(C)C

InChI

InChI=1S/C26H42N2O3/c1-5-6-13-27-14-16-28(17-15-27)24-18-22(31-19-25(29)30)11-12-23(24)20-7-9-21(10-8-20)26(2,3)4/h11-12,18,20-21H,5-10,13-17,19H2,1-4H3,(H,29,30)