(4E)-4-(chloranylmethylidene)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (4E)-4-(chloranylmethylidene)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Openeye Name: (4E)-1-tert-butoxycarbonyl-4-(chloromethylene)pyrrolidine-2-carboxylic acid CAS Name: (4E)-4-(chloromethylidene)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (4E)-4-(chloromethylidene)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid Traditional Name: (4E)-1-tert-butoxycarbonyl-4-(chloromethylene)proline Formula: C11H16ClNO4 MolecularWeight: 261.70204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(=CCl)CC1C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C/C(=C/Cl)/CC1C(=O)O

InChI

InChI=1S/C11H16ClNO4/c1-11(2,3)17-10(16)13-6-7(5-12)4-8(13)9(14)15/h5,8H,4,6H2,1-3H3,(H,14,15)/b7-5+