3-[2-(azetidin-1-yl)-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 3-[2-(azetidin-1-yl)-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 3-[2-(azetidin-1-yl)-2-oxo-ethoxy]benzoic acid CAS Name: 3-[2-(1-azetidinyl)-2-oxoethoxy]benzoic acid IUPAC Name: 3-[2-(azetidin-1-yl)-2-oxoethoxy]benzoic acid Traditional Name: 3-[2-(azetidin-1-yl)-2-keto-ethoxy]benzoic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)C(=O)COC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1CN(C1)C(=O)COC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C12H13NO4/c14-11(13-5-2-6-13)8-17-10-4-1-3-9(7-10)12(15)16/h1,3-4,7H,2,5-6,8H2,(H,15,16)