tert-butyl 3-iodanyl-6-phenylmethoxy-indole-1-carboxylate

Systemtic Name: tert-butyl 3-iodanyl-6-phenylmethoxy-indole-1-carboxylate Openeye Name: tert-butyl 6-benzyloxy-3-iodo-indole-1-carboxylate CAS Name: 3-iodo-6-phenylmethoxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-iodo-6-phenylmethoxyindole-1-carboxylate Traditional Name: 6-benzoxy-3-iodo-indole-1-carboxylic acid tert-butyl ester Formula: C20H20INO3 MolecularWeight: 449.28217

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)I

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)I

InChI

InChI=1S/C20H20INO3/c1-20(2,3)25-19(23)22-12-17(21)16-10-9-15(11-18(16)22)24-13-14-7-5-4-6-8-14/h4-12H,13H2,1-3H3