2-[3-tert-butyl-4-[[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-2-yl]methoxy]phenoxy]ethanoic acid

Systemtic Name: 2-[3-tert-butyl-4-[[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-2-yl]methoxy]phenoxy]ethanoic acid Openeye Name: 2-[3-tert-butyl-4-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]phenoxy]acetic acid CAS Name: 2-[3-tert-butyl-4-[[5-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-2-pyrrolidinyl]methoxy]phenoxy]acetic acid IUPAC Name: 2-[3-tert-butyl-4-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]phenoxy]acetic acid Traditional Name: 2-[3-tert-butyl-4-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]phenoxy]acetic acid Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)OCC(=O)O)OCC2CCC(N2)C(=O)N3CCCC3C#N

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)OCC(=O)O)OCC2CCC(N2)C(=O)N3CCCC3C#N

InChI

InChI=1S/C23H31N3O5/c1-23(2,3)18-11-17(30-14-21(27)28)7-9-20(18)31-13-15-6-8-19(25-15)22(29)26-10-4-5-16(26)12-24/h7,9,11,15-16,19,25H,4-6,8,10,13-14H2,1-3H3,(H,27,28)