2-[2-butan-2-yl-4-[3-butan-2-yl-4-(2-dimethylaminoethyloxy)phenyl]phenoxy]ethanoic acid

Systemtic Name: 2-[2-butan-2-yl-4-[3-butan-2-yl-4-(2-dimethylaminoethyloxy)phenyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[4-(2-dimethylaminoethyloxy)-3-sec-butyl-phenyl]-2-sec-butyl-phenoxy]acetic acid CAS Name: 2-[2-butan-2-yl-4-[3-butan-2-yl-4-(2-dimethylaminoethyloxy)phenyl]phenoxy]acetic acid IUPAC Name: 2-[2-butan-2-yl-4-[3-butan-2-yl-4-(2-dimethylaminoethyloxy)phenyl]phenoxy]acetic acid Traditional Name: 2-[4-[4-(2-dimethylaminoethyloxy)-3-sec-butyl-phenyl]-2-sec-butyl-phenoxy]acetic acid Formula: C26H37NO4 MolecularWeight: 427.57628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C=CC(=C1)C2=CC(=C(C=C2)OCC(=O)O)C(C)CC)OCCN(C)C

Isomeric SMILES

CCC(C)C1=C(C=CC(=C1)C2=CC(=C(C=C2)OCC(=O)O)C(C)CC)OCCN(C)C

InChI

InChI=1S/C26H37NO4/c1-7-18(3)22-15-20(9-11-24(22)30-14-13-27(5)6)21-10-12-25(31-17-26(28)29)23(16-21)19(4)8-2/h9-12,15-16,18-19H,7-8,13-14,17H2,1-6H3,(H,28,29)