[(3R,4R)-1-[(4-fluorophenyl)carbamoyl]-3-[4-(4-fluorophenyl)piperazin-1-yl]piperidin-4-yl] 3-phenylbenzoate

Systemtic Name: [(3R,4R)-1-[(4-fluorophenyl)carbamoyl]-3-[4-(4-fluorophenyl)piperazin-1-yl]piperidin-4-yl] 3-phenylbenzoate Openeye Name: [(3R,4R)-1-[(4-fluorophenyl)carbamoyl]-3-[4-(4-fluorophenyl)piperazin-1-yl]-4-piperidyl] 3-phenylbenzoate CAS Name: 3-phenylbenzoic acid [(3R,4R)-1-[(4-fluoroanilino)-oxomethyl]-3-[4-(4-fluorophenyl)-1-piperazinyl]-4-piperidinyl] ester IUPAC Name: [(3R,4R)-1-[(4-fluorophenyl)carbamoyl]-3-[4-(4-fluorophenyl)piperazin-1-yl]piperidin-4-yl] 3-phenylbenzoate Traditional Name: 3-phenylbenzoic acid [(3R,4R)-1-[(4-fluorophenyl)carbamoyl]-3-[4-(4-fluorophenyl)piperazino]-4-piperidyl] ester Formula: C35H34F2N4O3 MolecularWeight: 596.666266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1OC(=O)C2=CC=CC(=C2)C3=CC=CC=C3)N4CCN(CC4)C5=CC=C(C=C5)F)C(=O)NC6=CC=C(C=C6)F

Isomeric SMILES

C1CN(C[C@H]([C@@H]1OC(=O)C2=CC=CC(=C2)C3=CC=CC=C3)N4CCN(CC4)C5=CC=C(C=C5)F)C(=O)NC6=CC=C(C=C6)F

InChI

InChI=1S/C35H34F2N4O3/c36-28-9-13-30(14-10-28)38-35(43)41-18-17-33(44-34(42)27-8-4-7-26(23-27)25-5-2-1-3-6-25)32(24-41)40-21-19-39(20-22-40)31-15-11-29(37)12-16-31/h1-16,23,32-33H,17-22,24H2,(H,38,43)/t32-,33-/m1/s1