ethyl 4-[2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-amino]ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-amino]ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(2-chloro-6-fluoro-phenyl)methyl-cyclopropyl-amino]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[(2-chloro-6-fluorophenyl)methyl-cyclopropylamino]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(2-chloro-6-fluorophenyl)methyl-cyclopropylamino]acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[(2-chloro-6-fluoro-benzyl)-cyclopropyl-amino]acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H27ClFN3O3 MolecularWeight: 411.898083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CN(CC2=C(C=CC=C2Cl)F)C3CC3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CN(CC2=C(C=CC=C2Cl)F)C3CC3

InChI

InChI=1S/C20H27ClFN3O3/c1-2-28-20(27)24-10-8-14(9-11-24)23-19(26)13-25(15-6-7-15)12-16-17(21)4-3-5-18(16)22/h3-5,14-15H,2,6-13H2,1H3,(H,23,26)