(2-tert-butylcyclohexyl) 4-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]piperazine-1-carboxylate

Systemtic Name: (2-tert-butylcyclohexyl) 4-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]piperazine-1-carboxylate Openeye Name: (2-tert-butylcyclohexyl) 4-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-[(4-cyanophenyl)methyl]-4-imidazolyl]methyl]-1-piperazinecarboxylic acid (2-tert-butylcyclohexyl) ester IUPAC Name: (2-tert-butylcyclohexyl) 4-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[3-(4-cyanobenzyl)imidazol-4-yl]methyl]piperazine-1-carboxylic acid (2-tert-butylcyclohexyl) ester Formula: C27H37N5O2 MolecularWeight: 463.61498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCCCC1OC(=O)N2CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)(C)C1CCCCC1OC(=O)N2CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C27H37N5O2/c1-27(2,3)24-6-4-5-7-25(24)34-26(33)31-14-12-30(13-15-31)19-23-17-29-20-32(23)18-22-10-8-21(16-28)9-11-22/h8-11,17,20,24-25H,4-7,12-15,18-19H2,1-3H3