6-[[3,5-bis(fluoranyl)phenyl]carbamoylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[[3,5-bis(fluoranyl)phenyl]carbamoylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[(3,5-difluorophenyl)carbamoylamino]-6-oxo-hexanoic acid CAS Name: 6-[[(3,5-difluoroanilino)-oxomethyl]amino]-6-oxohexanoic acid IUPAC Name: 6-[(3,5-difluorophenyl)carbamoylamino]-6-oxohexanoic acid Traditional Name: 6-[(3,5-difluorophenyl)carbamoylamino]-6-keto-hexanoic acid Formula: C13H14F2N2O4 MolecularWeight: 300.258066

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1F)F)NC(=O)NC(=O)CCCCC(=O)O

Isomeric SMILES

C1=C(C=C(C=C1F)F)NC(=O)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C13H14F2N2O4/c14-8-5-9(15)7-10(6-8)16-13(21)17-11(18)3-1-2-4-12(19)20/h5-7H,1-4H2,(H,19,20)(H2,16,17,18,21)