4-[3-(2-tert-butyl-4-chloranyl-phenoxy)azetidin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3-(2-tert-butyl-4-chloranyl-phenoxy)azetidin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-(2-tert-butyl-4-chloro-phenoxy)azetidin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[3-(2-tert-butyl-4-chlorophenoxy)-1-azetidinyl]-4-oxobutanoic acid IUPAC Name: 4-[3-(2-tert-butyl-4-chlorophenoxy)azetidin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[3-(2-tert-butyl-4-chloro-phenoxy)azetidin-1-yl]-4-keto-butyric acid Formula: C17H22ClNO4 MolecularWeight: 339.81388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)Cl)OC2CN(C2)C(=O)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)Cl)OC2CN(C2)C(=O)CCC(=O)O

InChI

InChI=1S/C17H22ClNO4/c1-17(2,3)13-8-11(18)4-5-14(13)23-12-9-19(10-12)15(20)6-7-16(21)22/h4-5,8,12H,6-7,9-10H2,1-3H3,(H,21,22)