ethyl 4-[4-[(3-bromanyl-5-fluoranyl-phenyl)carbonylamino]butanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(3-bromanyl-5-fluoranyl-phenyl)carbonylamino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[(3-bromo-5-fluoro-benzoyl)amino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[(3-bromo-5-fluorophenyl)-oxomethyl]amino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-bromo-5-fluorobenzoyl)amino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[(3-bromo-5-fluoro-benzoyl)amino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C19H25BrFN3O4 MolecularWeight: 458.321903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25BrFN3O4/c1-2-28-19(27)24-8-5-16(6-9-24)23-17(25)4-3-7-22-18(26)13-10-14(20)12-15(21)11-13/h10-12,16H,2-9H2,1H3,(H,22,26)(H,23,25)