ethyl 4-[(3S)-4-(cyclohexylmethyl)-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(3S)-4-(cyclohexylmethyl)-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[(3S)-4-(cyclohexylmethyl)-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate CAS Name: 4-[(3S)-4-(cyclohexylmethyl)-3-(2-hydroxyethyl)-1-piperazinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3S)-4-(cyclohexylmethyl)-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[(3S)-4-(cyclohexylmethyl)-3-(2-hydroxyethyl)piperazino]piperidine-1-carboxylic acid ethyl ester Formula: C21H39N3O3 MolecularWeight: 381.55266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CCN(C(C2)CCO)CC3CCCCC3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CCN([C@H](C2)CCO)CC3CCCCC3

InChI

InChI=1S/C21H39N3O3/c1-2-27-21(26)22-11-8-19(9-12-22)24-14-13-23(20(17-24)10-15-25)16-18-6-4-3-5-7-18/h18-20,25H,2-17H2,1H3/t20-/m0/s1