methyl 4-[[3-(4-fluorophenyl)-6-(1-propan-2-ylpiperidin-4-yl)oxy-1-benzofuran-2-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[[3-(4-fluorophenyl)-6-(1-propan-2-ylpiperidin-4-yl)oxy-1-benzofuran-2-yl]carbonyl]piperazine-1-carboxylate Openeye Name: methyl 4-[3-(4-fluorophenyl)-6-[(1-isopropyl-4-piperidyl)oxy]benzofuran-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-(4-fluorophenyl)-6-[(1-propan-2-yl-4-piperidinyl)oxy]-2-benzofuranyl]-oxomethyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[3-(4-fluorophenyl)-6-(1-propan-2-ylpiperidin-4-yl)oxy-1-benzofuran-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[3-(4-fluorophenyl)-6-[(1-isopropyl-4-piperidyl)oxy]benzofuran-2-carbonyl]piperazine-1-carboxylic acid methyl ester Formula: C29H34FN3O5 MolecularWeight: 523.595763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)OC2=CC3=C(C=C2)C(=C(O3)C(=O)N4CCN(CC4)C(=O)OC)C5=CC=C(C=C5)F

Isomeric SMILES

CC(C)N1CCC(CC1)OC2=CC3=C(C=C2)C(=C(O3)C(=O)N4CCN(CC4)C(=O)OC)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H34FN3O5/c1-19(2)31-12-10-22(11-13-31)37-23-8-9-24-25(18-23)38-27(26(24)20-4-6-21(30)7-5-20)28(34)32-14-16-33(17-15-32)29(35)36-3/h4-9,18-19,22H,10-17H2,1-3H3