2-[(1R)-1-cyano-2,2-dimethyl-propoxy]carbonylbenzoic acid

Systemtic Name: 2-[(1R)-1-cyano-2,2-dimethyl-propoxy]carbonylbenzoic acid Openeye Name: 2-[(1R)-1-cyano-2,2-dimethyl-propoxy]carbonylbenzoic acid CAS Name: 2-[[(1R)-1-cyano-2,2-dimethylpropoxy]-oxomethyl]benzoic acid IUPAC Name: 2-[(1R)-1-cyano-2,2-dimethylpropoxy]carbonylbenzoic acid Traditional Name: 2-[(1R)-1-cyano-2,2-dimethyl-propoxy]carbonylbenzoic acid Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C#N)OC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(C)(C)[C@H](C#N)OC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C14H15NO4/c1-14(2,3)11(8-15)19-13(18)10-7-5-4-6-9(10)12(16)17/h4-7,11H,1-3H3,(H,16,17)/t11-/m0/s1