[4-(4-decoxy-3-fluoranyl-phenyl)-2-fluoranyl-phenyl] 3-ethylcyclobutane-1-carboxylate

Systemtic Name: [4-(4-decoxy-3-fluoranyl-phenyl)-2-fluoranyl-phenyl] 3-ethylcyclobutane-1-carboxylate Openeye Name: [4-(4-decoxy-3-fluoro-phenyl)-2-fluoro-phenyl] 3-ethylcyclobutanecarboxylate CAS Name: 3-ethyl-1-cyclobutanecarboxylic acid [4-(4-decoxy-3-fluorophenyl)-2-fluorophenyl] ester IUPAC Name: [4-(4-decoxy-3-fluorophenyl)-2-fluorophenyl] 3-ethylcyclobutane-1-carboxylate Traditional Name: 3-ethylcyclobutanecarboxylic acid [4-(4-decoxy-3-fluoro-phenyl)-2-fluoro-phenyl] ester Formula: C29H38F2O3 MolecularWeight: 472.607026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3CC(C3)CC)F)F

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3CC(C3)CC)F)F

InChI

InChI=1S/C29H38F2O3/c1-3-5-6-7-8-9-10-11-16-33-27-14-12-22(19-25(27)30)23-13-15-28(26(31)20-23)34-29(32)24-17-21(4-2)18-24/h12-15,19-21,24H,3-11,16-18H2,1-2H3