2-chloranyl-5-(3,3-dimethyl-2-oxidanylidene-azetidin-1-yl)benzoic acid

Systemtic Name: 2-chloranyl-5-(3,3-dimethyl-2-oxidanylidene-azetidin-1-yl)benzoic acid Openeye Name: 2-chloro-5-(3,3-dimethyl-2-oxo-azetidin-1-yl)benzoic acid CAS Name: 2-chloro-5-(3,3-dimethyl-2-oxo-1-azetidinyl)benzoic acid IUPAC Name: 2-chloro-5-(3,3-dimethyl-2-oxoazetidin-1-yl)benzoic acid Traditional Name: 2-chloro-5-(2-keto-3,3-dimethyl-azetidin-1-yl)benzoic acid Formula: C12H12ClNO3 MolecularWeight: 253.68158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C1=O)C2=CC(=C(C=C2)Cl)C(=O)O)C

Isomeric SMILES

CC1(CN(C1=O)C2=CC(=C(C=C2)Cl)C(=O)O)C

InChI

InChI=1S/C12H12ClNO3/c1-12(2)6-14(11(12)17)7-3-4-9(13)8(5-7)10(15)16/h3-5H,6H2,1-2H3,(H,15,16)