methyl 2-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]furan-3-carboxylate Openeye Name: methyl 2-[[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[[4-(3-fluoro-4-methoxy-benzyl)piperazino]methyl]furan-3-carboxylic acid methyl ester Formula: C19H23FN2O4 MolecularWeight: 362.395323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)CC3=C(C=CO3)C(=O)OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)CC3=C(C=CO3)C(=O)OC)F

InChI

InChI=1S/C19H23FN2O4/c1-24-17-4-3-14(11-16(17)20)12-21-6-8-22(9-7-21)13-18-15(5-10-26-18)19(23)25-2/h3-5,10-11H,6-9,12-13H2,1-2H3