[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl] 5-methoxy-2-oxidanyl-benzoate

Systemtic Name: [2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl] 5-methoxy-2-oxidanyl-benzoate Openeye Name: [2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxo-ethyl] 2-hydroxy-5-methoxy-benzoate CAS Name: 2-hydroxy-5-methoxybenzoic acid [2-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxoethyl] 2-hydroxy-5-methoxybenzoate Traditional Name: 2-hydroxy-5-methoxy-benzoic acid [2-[4-(2-fluorobenzyl)piperazino]-2-keto-ethyl] ester Formula: C21H23FN2O5 MolecularWeight: 402.416123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C(=O)OCC(=O)N2CCN(CC2)CC3=CC=CC=C3F

Isomeric SMILES

COC1=CC(=C(C=C1)O)C(=O)OCC(=O)N2CCN(CC2)CC3=CC=CC=C3F

InChI

InChI=1S/C21H23FN2O5/c1-28-16-6-7-19(25)17(12-16)21(27)29-14-20(26)24-10-8-23(9-11-24)13-15-4-2-3-5-18(15)22/h2-7,12,25H,8-11,13-14H2,1H3