2-[4-(1-benzofuran-2-ylmethyl)piperazin-1-yl]ethyl 4-(4-fluorophenyl)piperazine-1-carboxylate

Systemtic Name: 2-[4-(1-benzofuran-2-ylmethyl)piperazin-1-yl]ethyl 4-(4-fluorophenyl)piperazine-1-carboxylate Openeye Name: 2-[4-(benzofuran-2-ylmethyl)piperazin-1-yl]ethyl 4-(4-fluorophenyl)piperazine-1-carboxylate CAS Name: 4-(4-fluorophenyl)-1-piperazinecarboxylic acid 2-[4-(2-benzofuranylmethyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(1-benzofuran-2-ylmethyl)piperazin-1-yl]ethyl 4-(4-fluorophenyl)piperazine-1-carboxylate Traditional Name: 4-(4-fluorophenyl)piperazine-1-carboxylic acid 2-[4-(benzofuran-2-ylmethyl)piperazino]ethyl ester Formula: C26H31FN4O3 MolecularWeight: 466.547743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)CC4=CC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CCN1CCOC(=O)N2CCN(CC2)C3=CC=C(C=C3)F)CC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C26H31FN4O3/c27-22-5-7-23(8-6-22)30-13-15-31(16-14-30)26(32)33-18-17-28-9-11-29(12-10-28)20-24-19-21-3-1-2-4-25(21)34-24/h1-8,19H,9-18,20H2