(2S)-1-[(2S)-2-(2-chloranylethanoylamino)-4-methyl-pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2S)-2-(2-chloranylethanoylamino)-4-methyl-pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2S)-2-[(2-chloroacetyl)amino]-4-methyl-pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2S)-2-[(2-chloro-1-oxoethyl)amino]-4-methyl-1-oxopentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2S)-2-[(2-chloroacetyl)amino]-4-methylpentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2S)-2-[(2-chloroacetyl)amino]-4-methyl-pentanoyl]proline Formula: C13H21ClN2O4 MolecularWeight: 304.76984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCCC1C(=O)O)NC(=O)CCl

Isomeric SMILES

CC(C)C[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)CCl

InChI

InChI=1S/C13H21ClN2O4/c1-8(2)6-9(15-11(17)7-14)12(18)16-5-3-4-10(16)13(19)20/h8-10H,3-7H2,1-2H3,(H,15,17)(H,19,20)/t9-,10-/m0/s1