methyl 2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methoxy-benzoate

Systemtic Name: methyl 2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]-4-methoxy-benzoate Openeye Name: methyl 2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethoxy]-4-methoxy-benzoate CAS Name: 2-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethoxy]-4-methoxybenzoic acid methyl ester IUPAC Name: methyl 2-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethoxy]-4-methoxybenzoate Traditional Name: 2-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethoxy]-4-methoxy-benzoic acid methyl ester Formula: C21H23FN2O5 MolecularWeight: 402.416123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OC)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OC)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN2O5/c1-27-17-7-8-18(21(26)28-2)19(13-17)29-14-20(25)24-11-9-23(10-12-24)16-5-3-15(22)4-6-16/h3-8,13H,9-12,14H2,1-2H3