2-[[[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]amino]methyl]pyrrolidine-1-carboxylic acid

Systemtic Name: 2-[[[4-[(7-chloranylquinolin-4-yl)amino]cyclohexyl]amino]methyl]pyrrolidine-1-carboxylic acid Openeye Name: 2-[[[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]amino]methyl]pyrrolidine-1-carboxylic acid CAS Name: 2-[[[4-[(7-chloro-4-quinolinyl)amino]cyclohexyl]amino]methyl]-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[[[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]amino]methyl]pyrrolidine-1-carboxylic acid Traditional Name: 2-[[[4-[(7-chloro-4-quinolyl)amino]cyclohexyl]amino]methyl]pyrrolidine-1-carboxylic acid Formula: C21H27ClN4O2 MolecularWeight: 402.91768

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)O)CNC2CCC(CC2)NC3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

C1CC(N(C1)C(=O)O)CNC2CCC(CC2)NC3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C21H27ClN4O2/c22-14-3-8-18-19(9-10-23-20(18)12-14)25-16-6-4-15(5-7-16)24-13-17-2-1-11-26(17)21(27)28/h3,8-10,12,15-17,24H,1-2,4-7,11,13H2,(H,23,25)(H,27,28)