tert-butyl (2S)-2-[(5-bromanyl-2-methoxy-3-methoxycarbonyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(5-bromanyl-2-methoxy-3-methoxycarbonyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(5-bromo-2-methoxy-3-methoxycarbonyl-phenyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(5-bromo-2-methoxy-3-methoxycarbonylanilino)-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(5-bromo-2-methoxy-3-methoxycarbonylphenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(5-bromo-3-carbomethoxy-2-methoxy-phenyl)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H25BrN2O6 MolecularWeight: 457.3156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC2=C(C(=CC(=C2)Br)C(=O)OC)OC

InChI

InChI=1S/C19H25BrN2O6/c1-19(2,3)28-18(25)22-8-6-7-14(22)16(23)21-13-10-11(20)9-12(15(13)26-4)17(24)27-5/h9-10,14H,6-8H2,1-5H3,(H,21,23)/t14-/m0/s1