tert-butyl 3-iodanyl-7-(3-methylbut-2-enyl)indole-1-carboxylate

Systemtic Name: tert-butyl 3-iodanyl-7-(3-methylbut-2-enyl)indole-1-carboxylate Openeye Name: tert-butyl 3-iodo-7-(3-methylbut-2-enyl)indole-1-carboxylate CAS Name: 3-iodo-7-(3-methylbut-2-enyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-iodo-7-(3-methylbut-2-enyl)indole-1-carboxylate Traditional Name: 3-iodo-7-(3-methylbut-2-enyl)indole-1-carboxylic acid tert-butyl ester Formula: C18H22INO2 MolecularWeight: 411.27725

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=CC=CC2=C1N(C=C2I)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC(=CCC1=CC=CC2=C1N(C=C2I)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C18H22INO2/c1-12(2)9-10-13-7-6-8-14-15(19)11-20(16(13)14)17(21)22-18(3,4)5/h6-9,11H,10H2,1-5H3