tert-butyl 2-[(4-iodophenyl)carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[(4-iodophenyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[(4-iodophenyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[(4-iodoanilino)-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-iodophenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(4-iodophenyl)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C16H21IN2O3 MolecularWeight: 416.25401

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)I

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)I

InChI

InChI=1S/C16H21IN2O3/c1-16(2,3)22-15(21)19-10-4-5-13(19)14(20)18-12-8-6-11(17)7-9-12/h6-9,13H,4-5,10H2,1-3H3,(H,18,20)