ethyl 4-[4-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]butanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(2-chloranyl-6-fluoranyl-phenyl)carbonylamino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[(2-chloro-6-fluoro-benzoyl)amino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[(2-chloro-6-fluorophenyl)-oxomethyl]amino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2-chloro-6-fluorobenzoyl)amino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-chloro-6-fluoro-benzoyl)amino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C19H25ClFN3O4 MolecularWeight: 413.870903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C2=C(C=CC=C2Cl)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C2=C(C=CC=C2Cl)F

InChI

InChI=1S/C19H25ClFN3O4/c1-2-28-19(27)24-11-8-13(9-12-24)23-16(25)7-4-10-22-18(26)17-14(20)5-3-6-15(17)21/h3,5-6,13H,2,4,7-12H2,1H3,(H,22,26)(H,23,25)