3-[(2,6-dimethylcyclohexyl)amino]benzoic acid

Systemtic Name: 3-[(2,6-dimethylcyclohexyl)amino]benzoic acid Openeye Name: 3-[(2,6-dimethylcyclohexyl)amino]benzoic acid CAS Name: 3-[(2,6-dimethylcyclohexyl)amino]benzoic acid IUPAC Name: 3-[(2,6-dimethylcyclohexyl)amino]benzoic acid Traditional Name: 3-[(2,6-dimethylcyclohexyl)amino]benzoic acid Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1NC2=CC=CC(=C2)C(=O)O)C

Isomeric SMILES

CC1CCCC(C1NC2=CC=CC(=C2)C(=O)O)C

InChI

InChI=1S/C15H21NO2/c1-10-5-3-6-11(2)14(10)16-13-8-4-7-12(9-13)15(17)18/h4,7-11,14,16H,3,5-6H2,1-2H3,(H,17,18)