tert-butyl 4-iodanyl-2-(4-methoxyphenyl)pyrrole-1-carboxylate

Systemtic Name: tert-butyl 4-iodanyl-2-(4-methoxyphenyl)pyrrole-1-carboxylate Openeye Name: tert-butyl 4-iodo-2-(4-methoxyphenyl)pyrrole-1-carboxylate CAS Name: 4-iodo-2-(4-methoxyphenyl)-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-iodo-2-(4-methoxyphenyl)pyrrole-1-carboxylate Traditional Name: 4-iodo-2-(4-methoxyphenyl)pyrrole-1-carboxylic acid tert-butyl ester Formula: C16H18INO3 MolecularWeight: 399.22349

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C=C1C2=CC=C(C=C2)OC)I

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C=C1C2=CC=C(C=C2)OC)I

InChI

InChI=1S/C16H18INO3/c1-16(2,3)21-15(19)18-10-12(17)9-14(18)11-5-7-13(20-4)8-6-11/h5-10H,1-4H3