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

Systemtic Name: tert-butyl 4-[(4-ethyl-2-iodanyl-phenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(4-ethyl-2-iodo-phenyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[(4-ethyl-2-iodoanilino)-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-ethyl-2-iodophenyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(4-ethyl-2-iodo-phenyl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H27IN2O3 MolecularWeight: 458.33375

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)I

Isomeric SMILES

CCC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)I

InChI

InChI=1S/C19H27IN2O3/c1-5-13-6-7-16(15(20)12-13)21-17(23)14-8-10-22(11-9-14)18(24)25-19(2,3)4/h6-7,12,14H,5,8-11H2,1-4H3,(H,21,23)