3-(4-chloranyl-2-fluoranyl-phenyl)-2-(prop-2-enoylamino)hexanoic acid

Systemtic Name: 3-(4-chloranyl-2-fluoranyl-phenyl)-2-(prop-2-enoylamino)hexanoic acid Openeye Name: 3-(4-chloro-2-fluoro-phenyl)-2-(prop-2-enoylamino)hexanoic acid CAS Name: 3-(4-chloro-2-fluorophenyl)-2-(1-oxoprop-2-enylamino)hexanoic acid IUPAC Name: 3-(4-chloro-2-fluorophenyl)-2-(prop-2-enoylamino)hexanoic acid Traditional Name: 2-acrylamido-3-(4-chloro-2-fluoro-phenyl)hexanoic acid Formula: C15H17ClFNO3 MolecularWeight: 313.751783

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C=C(C=C1)Cl)F)C(C(=O)O)NC(=O)C=C

Isomeric SMILES

CCCC(C1=C(C=C(C=C1)Cl)F)C(C(=O)O)NC(=O)C=C

InChI

InChI=1S/C15H17ClFNO3/c1-3-5-11(10-7-6-9(16)8-12(10)17)14(15(20)21)18-13(19)4-2/h4,6-8,11,14H,2-3,5H2,1H3,(H,18,19)(H,20,21)