1,3-bis(chloranyl)propan-2-yl 4-[(2-fluorophenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 1,3-bis(chloranyl)propan-2-yl 4-[(2-fluorophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-chloro-1-(chloromethyl)ethyl] 4-(2-fluoroanilino)-4-oxo-butanoate CAS Name: 4-(2-fluoroanilino)-4-oxobutanoic acid 1,3-dichloropropan-2-yl ester IUPAC Name: 1,3-dichloropropan-2-yl 4-(2-fluoroanilino)-4-oxobutanoate Traditional Name: 4-(2-fluoroanilino)-4-keto-butyric acid [2-chloro-1-(chloromethyl)ethyl] ester Formula: C13H14Cl2FNO3 MolecularWeight: 322.159563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCC(=O)OC(CCl)CCl)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCC(=O)OC(CCl)CCl)F

InChI

InChI=1S/C13H14Cl2FNO3/c14-7-9(8-15)20-13(19)6-5-12(18)17-11-4-2-1-3-10(11)16/h1-4,9H,5-8H2,(H,17,18)