4-[2-(4-tert-butylcyclohexyl)phenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[2-(4-tert-butylcyclohexyl)phenyl]piperazine-1-carboxylic acid Openeye Name: 4-[2-(4-tert-butylcyclohexyl)phenyl]piperazine-1-carboxylic acid CAS Name: 4-[2-(4-tert-butylcyclohexyl)phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[2-(4-tert-butylcyclohexyl)phenyl]piperazine-1-carboxylic acid Traditional Name: 4-[2-(4-tert-butylcyclohexyl)phenyl]piperazine-1-carboxylic acid Formula: C21H32N2O2 MolecularWeight: 344.49098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C2=CC=CC=C2N3CCN(CC3)C(=O)O

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C2=CC=CC=C2N3CCN(CC3)C(=O)O

InChI

InChI=1S/C21H32N2O2/c1-21(2,3)17-10-8-16(9-11-17)18-6-4-5-7-19(18)22-12-14-23(15-13-22)20(24)25/h4-7,16-17H,8-15H2,1-3H3,(H,24,25)