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

Systemtic Name: 2-[4-chloranyl-3-[[5-(2-cyanopyrrolidin-1-yl)carbonylpyrrolidin-2-yl]methoxy]phenoxy]ethanoic acid Openeye Name: 2-[4-chloro-3-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]phenoxy]acetic acid CAS Name: 2-[4-chloro-3-[[5-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-2-pyrrolidinyl]methoxy]phenoxy]acetic acid IUPAC Name: 2-[4-chloro-3-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]phenoxy]acetic acid Traditional Name: 2-[4-chloro-3-[[5-(2-cyanopyrrolidine-1-carbonyl)pyrrolidin-2-yl]methoxy]phenoxy]acetic acid Formula: C19H22ClN3O5 MolecularWeight: 407.84808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C(C=CC(=C3)OCC(=O)O)Cl)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCC(N2)COC3=C(C=CC(=C3)OCC(=O)O)Cl)C#N

InChI

InChI=1S/C19H22ClN3O5/c20-15-5-4-14(27-11-18(24)25)8-17(15)28-10-12-3-6-16(22-12)19(26)23-7-1-2-13(23)9-21/h4-5,8,12-13,16,22H,1-3,6-7,10-11H2,(H,24,25)