4-[5-methoxy-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[5-methoxy-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid Openeye Name: 4-[5-methoxy-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid CAS Name: 4-[5-methoxy-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[5-methoxy-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid Traditional Name: 4-[5-methoxy-2-(3,3,5,5-tetramethylcyclohexyl)phenyl]piperazine-1-carboxylic acid Formula: C22H34N2O3 MolecularWeight: 374.51696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)C)C2=C(C=C(C=C2)OC)N3CCN(CC3)C(=O)O)C

Isomeric SMILES

CC1(CC(CC(C1)(C)C)C2=C(C=C(C=C2)OC)N3CCN(CC3)C(=O)O)C

InChI

InChI=1S/C22H34N2O3/c1-21(2)13-16(14-22(3,4)15-21)18-7-6-17(27-5)12-19(18)23-8-10-24(11-9-23)20(25)26/h6-7,12,16H,8-11,13-15H2,1-5H3,(H,25,26)