2-methylpropyl (2S,4R)-2-[(4-iodanyl-3-methyl-phenyl)carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: 2-methylpropyl (2S,4R)-2-[(4-iodanyl-3-methyl-phenyl)carbamoyl]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: isobutyl (2S,4R)-4-hydroxy-2-[(4-iodo-3-methyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S,4R)-4-hydroxy-2-[(4-iodo-3-methylanilino)-oxomethyl]-1-pyrrolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2S,4R)-4-hydroxy-2-[(4-iodo-3-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S,4R)-4-hydroxy-2-[(4-iodo-3-methyl-phenyl)carbamoyl]pyrrolidine-1-carboxylic acid isobutyl ester Formula: C17H23IN2O4 MolecularWeight: 446.27999

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CC(CN2C(=O)OCC(C)C)O)I

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)[C@@H]2C[C@H](CN2C(=O)OCC(C)C)O)I

InChI

InChI=1S/C17H23IN2O4/c1-10(2)9-24-17(23)20-8-13(21)7-15(20)16(22)19-12-4-5-14(18)11(3)6-12/h4-6,10,13,15,21H,7-9H2,1-3H3,(H,19,22)/t13-,15+/m1/s1