tert-butyl (2S)-2-[(4-iodanyl-2-methyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(4-iodanyl-2-methyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(4-iodo-2-methyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(4-iodo-2-methylanilino)-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(4-iodo-2-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(4-iodo-2-methyl-phenyl)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H23IN2O3 MolecularWeight: 430.28059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)C2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C17H23IN2O3/c1-11-10-12(18)7-8-13(11)19-15(21)14-6-5-9-20(14)16(22)23-17(2,3)4/h7-8,10,14H,5-6,9H2,1-4H3,(H,19,21)/t14-/m0/s1