[2-(4-fluorophenyl)-4-methoxy-6-propan-2-yl-3-(pyridin-4-ylmethoxy)phenyl] 5-oxidanyl-3-oxidanylidene-hept-6-enoate

Systemtic Name: [2-(4-fluorophenyl)-4-methoxy-6-propan-2-yl-3-(pyridin-4-ylmethoxy)phenyl] 5-oxidanyl-3-oxidanylidene-hept-6-enoate Openeye Name: [2-(4-fluorophenyl)-6-isopropyl-4-methoxy-3-(4-pyridylmethoxy)phenyl] 5-hydroxy-3-oxo-hept-6-enoate CAS Name: 5-hydroxy-3-oxo-6-heptenoic acid [2-(4-fluorophenyl)-4-methoxy-6-propan-2-yl-3-(pyridin-4-ylmethoxy)phenyl] ester IUPAC Name: [2-(4-fluorophenyl)-4-methoxy-6-propan-2-yl-3-(pyridin-4-ylmethoxy)phenyl] 5-hydroxy-3-oxohept-6-enoate Traditional Name: 5-hydroxy-3-keto-hept-6-enoic acid [2-(4-fluorophenyl)-6-isopropyl-4-methoxy-3-(4-pyridylmethoxy)phenyl] ester Formula: C29H30FNO6 MolecularWeight: 507.550003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1OC(=O)CC(=O)CC(C=C)O)C2=CC=C(C=C2)F)OCC3=CC=NC=C3)OC

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1OC(=O)CC(=O)CC(C=C)O)C2=CC=C(C=C2)F)OCC3=CC=NC=C3)OC

InChI

InChI=1S/C29H30FNO6/c1-5-22(32)14-23(33)15-26(34)37-28-24(18(2)3)16-25(35-4)29(36-17-19-10-12-31-13-11-19)27(28)20-6-8-21(30)9-7-20/h5-13,16,18,22,32H,1,14-15,17H2,2-4H3