tert-butyl 2-[[4-(4-acetyloxyphenyl)phenoxy]methyl]-6-fluoranyl-indole-1-carboxylate

Systemtic Name: tert-butyl 2-[[4-(4-acetyloxyphenyl)phenoxy]methyl]-6-fluoranyl-indole-1-carboxylate Openeye Name: tert-butyl 2-[[4-(4-acetoxyphenyl)phenoxy]methyl]-6-fluoro-indole-1-carboxylate CAS Name: 2-[[4-(4-acetyloxyphenyl)phenoxy]methyl]-6-fluoro-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-(4-acetyloxyphenyl)phenoxy]methyl]-6-fluoroindole-1-carboxylate Traditional Name: 2-[[4-(4-acetoxyphenyl)phenoxy]methyl]-6-fluoro-indole-1-carboxylic acid tert-butyl ester Formula: C28H26FNO5 MolecularWeight: 475.508143

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=CC4=C(N3C(=O)OC(C)(C)C)C=C(C=C4)F

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=CC4=C(N3C(=O)OC(C)(C)C)C=C(C=C4)F

InChI

InChI=1S/C28H26FNO5/c1-18(31)34-25-13-8-20(9-14-25)19-6-11-24(12-7-19)33-17-23-15-21-5-10-22(29)16-26(21)30(23)27(32)35-28(2,3)4/h5-16H,17H2,1-4H3