[(4S)-3-[4-(4-fluorophenyl)-4-oxidanyl-piperidin-1-yl]-7-phenylmethoxy-4H-chromen-4-yl] ethanoate

Systemtic Name: [(4S)-3-[4-(4-fluorophenyl)-4-oxidanyl-piperidin-1-yl]-7-phenylmethoxy-4H-chromen-4-yl] ethanoate Openeye Name: [(4S)-7-benzyloxy-3-[4-(4-fluorophenyl)-4-hydroxy-1-piperidyl]-4H-chromen-4-yl] acetate CAS Name: acetic acid [(4S)-3-[4-(4-fluorophenyl)-4-hydroxy-1-piperidinyl]-7-phenylmethoxy-4H-1-benzopyran-4-yl] ester IUPAC Name: [(4S)-3-[4-(4-fluorophenyl)-4-hydroxypiperidin-1-yl]-7-phenylmethoxy-4H-chromen-4-yl] acetate Traditional Name: acetic acid [(4S)-7-benzoxy-3-[4-(4-fluorophenyl)-4-hydroxy-piperidino]-4H-chromen-4-yl] ester Formula: C29H28FNO5 MolecularWeight: 489.534723

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2=C(C=C(C=C2)OCC3=CC=CC=C3)OC=C1N4CCC(CC4)(C5=CC=C(C=C5)F)O

Isomeric SMILES

CC(=O)O[C@H]1C2=C(C=C(C=C2)OCC3=CC=CC=C3)OC=C1N4CCC(CC4)(C5=CC=C(C=C5)F)O

InChI

InChI=1S/C29H28FNO5/c1-20(32)36-28-25-12-11-24(34-18-21-5-3-2-4-6-21)17-27(25)35-19-26(28)31-15-13-29(33,14-16-31)22-7-9-23(30)10-8-22/h2-12,17,19,28,33H,13-16,18H2,1H3/t28-/m0/s1