tert-butyl 3-[(2-iodanylphenyl)-methyl-carbamoyl]pyrrole-1-carboxylate

Systemtic Name: tert-butyl 3-[(2-iodanylphenyl)-methyl-carbamoyl]pyrrole-1-carboxylate Openeye Name: tert-butyl 3-[(2-iodophenyl)-methyl-carbamoyl]pyrrole-1-carboxylate CAS Name: 3-[(2-iodo-N-methylanilino)-oxomethyl]-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(2-iodophenyl)-methylcarbamoyl]pyrrole-1-carboxylate Traditional Name: 3-[(2-iodophenyl)-methyl-carbamoyl]pyrrole-1-carboxylic acid tert-butyl ester Formula: C17H19IN2O3 MolecularWeight: 426.24883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC(=C1)C(=O)N(C)C2=CC=CC=C2I

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC(=C1)C(=O)N(C)C2=CC=CC=C2I

InChI

InChI=1S/C17H19IN2O3/c1-17(2,3)23-16(22)20-10-9-12(11-20)15(21)19(4)14-8-6-5-7-13(14)18/h5-11H,1-4H3