2-[[(1-tert-butylcyclohexyl)amino]methyl]benzoic acid

Systemtic Name: 2-[[(1-tert-butylcyclohexyl)amino]methyl]benzoic acid Openeye Name: 2-[[(1-tert-butylcyclohexyl)amino]methyl]benzoic acid CAS Name: 2-[[(1-tert-butylcyclohexyl)amino]methyl]benzoic acid IUPAC Name: 2-[[(1-tert-butylcyclohexyl)amino]methyl]benzoic acid Traditional Name: 2-[[(1-tert-butylcyclohexyl)amino]methyl]benzoic acid Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CCCCC1)NCC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)(C)C1(CCCCC1)NCC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H27NO2/c1-17(2,3)18(11-7-4-8-12-18)19-13-14-9-5-6-10-15(14)16(20)21/h5-6,9-10,19H,4,7-8,11-13H2,1-3H3,(H,20,21)