2-aminocarbonyl-2-[(3-bromophenyl)-cyano-methyl]pyrrolidine-1-carboxylic acid

Systemtic Name: 2-aminocarbonyl-2-[(3-bromophenyl)-cyano-methyl]pyrrolidine-1-carboxylic acid Openeye Name: 2-[(3-bromophenyl)-cyano-methyl]-2-carbamoyl-pyrrolidine-1-carboxylic acid CAS Name: 2-[(3-bromophenyl)-cyanomethyl]-2-carbamoyl-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[(3-bromophenyl)-cyanomethyl]-2-carbamoylpyrrolidine-1-carboxylic acid Traditional Name: 2-[(3-bromophenyl)-cyano-methyl]-2-carbamoyl-pyrrolidine-1-carboxylic acid Formula: C14H14BrN3O3 MolecularWeight: 352.18326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)O)(C(C#N)C2=CC(=CC=C2)Br)C(=O)N

Isomeric SMILES

C1CC(N(C1)C(=O)O)(C(C#N)C2=CC(=CC=C2)Br)C(=O)N

InChI

InChI=1S/C14H14BrN3O3/c15-10-4-1-3-9(7-10)11(8-16)14(12(17)19)5-2-6-18(14)13(20)21/h1,3-4,7,11H,2,5-6H2,(H2,17,19)(H,20,21)