(2R)-1-[6-chloranyl-5-(2-cyclohexylethanoylamino)quinolin-2-yl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2R)-1-[6-chloranyl-5-(2-cyclohexylethanoylamino)quinolin-2-yl]pyrrolidine-2-carboxylic acid Openeye Name: (2R)-1-[6-chloro-5-[(2-cyclohexylacetyl)amino]-2-quinolyl]pyrrolidine-2-carboxylic acid CAS Name: (2R)-1-[6-chloro-5-[(2-cyclohexyl-1-oxoethyl)amino]-2-quinolinyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R)-1-[6-chloro-5-[(2-cyclohexylacetyl)amino]quinolin-2-yl]pyrrolidine-2-carboxylic acid Traditional Name: (2R)-1-[6-chloro-5-[(2-cyclohexylacetyl)amino]-2-quinolyl]proline Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)NC2=C(C=CC3=C2C=CC(=N3)N4CCCC4C(=O)O)Cl

Isomeric SMILES

C1CCC(CC1)CC(=O)NC2=C(C=CC3=C2C=CC(=N3)N4CCC[C@@H]4C(=O)O)Cl

InChI

InChI=1S/C22H26ClN3O3/c23-16-9-10-17-15(21(16)25-20(27)13-14-5-2-1-3-6-14)8-11-19(24-17)26-12-4-7-18(26)22(28)29/h8-11,14,18H,1-7,12-13H2,(H,25,27)(H,28,29)/t18-/m1/s1