ethyl 4-[4-[(2-fluorophenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(2-fluorophenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[(2-fluorophenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-fluorophenyl)methyl]-3-(2-hydroxyethyl)-1-piperazinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2-fluorophenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2-fluorobenzyl)-3-(2-hydroxyethyl)piperazino]piperidine-1-carboxylic acid ethyl ester Formula: C21H32FN3O3 MolecularWeight: 393.495483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CCN(C(C2)CCO)CC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CCN(C(C2)CCO)CC3=CC=CC=C3F

InChI

InChI=1S/C21H32FN3O3/c1-2-28-21(27)23-10-7-18(8-11-23)25-13-12-24(19(16-25)9-14-26)15-17-5-3-4-6-20(17)22/h3-6,18-19,26H,2,7-16H2,1H3