ethyl 4-[(2S)-3-(4-cyclohexylphenoxy)-2-oxidanyl-propyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2S)-3-(4-cyclohexylphenoxy)-2-oxidanyl-propyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(2S)-3-(4-cyclohexylphenoxy)-2-hydroxy-propyl]piperazine-1-carboxylate CAS Name: 4-[(2S)-3-(4-cyclohexylphenoxy)-2-hydroxypropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2S)-3-(4-cyclohexylphenoxy)-2-hydroxypropyl]piperazine-1-carboxylate Traditional Name: 4-[(2S)-3-(4-cyclohexylphenoxy)-2-hydroxy-propyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H34N2O4 MolecularWeight: 390.51636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(COC2=CC=C(C=C2)C3CCCCC3)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C[C@@H](COC2=CC=C(C=C2)C3CCCCC3)O

InChI

InChI=1S/C22H34N2O4/c1-2-27-22(26)24-14-12-23(13-15-24)16-20(25)17-28-21-10-8-19(9-11-21)18-6-4-3-5-7-18/h8-11,18,20,25H,2-7,12-17H2,1H3/t20-/m0/s1