3-(2-cyanopropan-2-ylamino)benzoic acid

Systemtic Name: 3-(2-cyanopropan-2-ylamino)benzoic acid Openeye Name: 3-[(1-cyano-1-methyl-ethyl)amino]benzoic acid CAS Name: 3-(2-cyanopropan-2-ylamino)benzoic acid IUPAC Name: 3-(2-cyanopropan-2-ylamino)benzoic acid Traditional Name: 3-[(1-cyano-1-methyl-ethyl)amino]benzoic acid Formula: C11H12N2O2 MolecularWeight: 204.22518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)NC1=CC=CC(=C1)C(=O)O

Isomeric SMILES

CC(C)(C#N)NC1=CC=CC(=C1)C(=O)O

InChI

InChI=1S/C11H12N2O2/c1-11(2,7-12)13-9-5-3-4-8(6-9)10(14)15/h3-6,13H,1-2H3,(H,14,15)