tert-butyl 4-[(4-ethanoyl-2-iodanyl-phenyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-ethanoyl-2-iodanyl-phenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(4-acetyl-2-iodo-phenyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[(4-acetyl-2-iodoanilino)-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-acetyl-2-iodophenyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(4-acetyl-2-iodo-phenyl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H25IN2O4 MolecularWeight: 472.31727

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)I

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)I

InChI

InChI=1S/C19H25IN2O4/c1-12(23)14-5-6-16(15(20)11-14)21-17(24)13-7-9-22(10-8-13)18(25)26-19(2,3)4/h5-6,11,13H,7-10H2,1-4H3,(H,21,24)