3-[[2-[(4-chloranyl-2-fluoranyl-phenyl)carbamoyl]cyclohexen-1-yl]carbonylamino]propyl ethanoate

Systemtic Name: 3-[[2-[(4-chloranyl-2-fluoranyl-phenyl)carbamoyl]cyclohexen-1-yl]carbonylamino]propyl ethanoate Openeye Name: 3-[[2-[(4-chloro-2-fluoro-phenyl)carbamoyl]cyclohexene-1-carbonyl]amino]propyl acetate CAS Name: acetic acid 3-[[[2-[(4-chloro-2-fluoroanilino)-oxomethyl]-1-cyclohexenyl]-oxomethyl]amino]propyl ester IUPAC Name: 3-[[2-[(4-chloro-2-fluorophenyl)carbamoyl]cyclohexene-1-carbonyl]amino]propyl acetate Traditional Name: acetic acid 3-[[2-[(4-chloro-2-fluoro-phenyl)carbamoyl]cyclohexene-1-carbonyl]amino]propyl ester Formula: C19H22ClFN2O4 MolecularWeight: 396.840383

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCNC(=O)C1=C(CCCC1)C(=O)NC2=C(C=C(C=C2)Cl)F

Isomeric SMILES

CC(=O)OCCCNC(=O)C1=C(CCCC1)C(=O)NC2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C19H22ClFN2O4/c1-12(24)27-10-4-9-22-18(25)14-5-2-3-6-15(14)19(26)23-17-8-7-13(20)11-16(17)21/h7-8,11H,2-6,9-10H2,1H3,(H,22,25)(H,23,26)