4-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]butanoate

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]butanoate Openeye Name: 4-[(3-chloro-4-fluoro-phenyl)carbamoylamino]butanoate CAS Name: 4-[[(3-chloro-4-fluoroanilino)-oxomethyl]amino]butanoate IUPAC Name: 4-[(3-chloro-4-fluorophenyl)carbamoylamino]butanoate Traditional Name: 4-[(3-chloro-4-fluoro-phenyl)carbamoylamino]butyrate Formula: C11H11ClFN2O3- MolecularWeight: 273.668043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)NCCCC(=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)NCCCC(=O)[O-])Cl)F

InChI

InChI=1S/C11H12ClFN2O3/c12-8-6-7(3-4-9(8)13)15-11(18)14-5-1-2-10(16)17/h3-4,6H,1-2,5H2,(H,16,17)(H2,14,15,18)/p-1