ethyl 4-[2-[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]oxyethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]oxyethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]oxyacetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]oxyacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]oxyacetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H22BrFN2O5 MolecularWeight: 457.290783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)COC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)COC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C19H22BrFN2O5/c1-2-27-19(26)23-9-7-15(8-10-23)22-17(24)12-28-18(25)6-3-13-11-14(20)4-5-16(13)21/h3-6,11,15H,2,7-10,12H2,1H3,(H,22,24)/b6-3+