tert-butyl 1-[(2-iodanylphenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 1-[(2-iodanylphenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 1-[(2-iodophenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-[(2-iodophenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[(2-iodophenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-(2-iodobenzyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C21H24INO2 MolecularWeight: 449.32523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=CC=CC=C2C1CC3=CC=CC=C3I

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=CC=CC=C2C1CC3=CC=CC=C3I

InChI

InChI=1S/C21H24INO2/c1-21(2,3)25-20(24)23-13-12-15-8-4-6-10-17(15)19(23)14-16-9-5-7-11-18(16)22/h4-11,19H,12-14H2,1-3H3