4-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]benzoic acid

Systemtic Name: 4-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]benzoic acid Openeye Name: 4-[[4-(1,1-dimethylpropyl)cyclohexyl]amino]benzoic acid CAS Name: 4-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]benzoic acid IUPAC Name: 4-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]benzoic acid Traditional Name: 4-[(4-tert-amylcyclohexyl)amino]benzoic acid Formula: C18H27NO2 MolecularWeight: 289.41248

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)NC2=CC=C(C=C2)C(=O)O

InChI

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