3,3-bis(fluoranyl)-4-oxidanylidene-4-[(phenylmethyl)amino]butanoic acid

Systemtic Name: 3,3-bis(fluoranyl)-4-oxidanylidene-4-[(phenylmethyl)amino]butanoic acid Openeye Name: 4-(benzylamino)-3,3-difluoro-4-oxo-butanoic acid CAS Name: 3,3-difluoro-4-oxo-4-[(phenylmethyl)amino]butanoic acid IUPAC Name: 4-(benzylamino)-3,3-difluoro-4-oxobutanoic acid Traditional Name: 4-(benzylamino)-3,3-difluoro-4-keto-butyric acid Formula: C11H11F2NO3 MolecularWeight: 243.206746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(CC(=O)O)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(CC(=O)O)(F)F

InChI

InChI=1S/C11H11F2NO3/c12-11(13,6-9(15)16)10(17)14-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,14,17)(H,15,16)