4-[(4-fluorophenyl)amino]-2-(furan-2-ylmethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-fluorophenyl)amino]-2-(furan-2-ylmethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-fluoroanilino)-2-(2-furylmethylamino)-4-oxo-butanoic acid CAS Name: 4-(4-fluoroanilino)-2-(2-furanylmethylamino)-4-oxobutanoic acid IUPAC Name: 4-(4-fluoroanilino)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid Traditional Name: 4-(4-fluoroanilino)-2-(2-furfurylamino)-4-keto-butyric acid Formula: C15H15FN2O4 MolecularWeight: 306.289003

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(CC(=O)NC2=CC=C(C=C2)F)C(=O)O

Isomeric SMILES

C1=COC(=C1)CNC(CC(=O)NC2=CC=C(C=C2)F)C(=O)O

InChI

InChI=1S/C15H15FN2O4/c16-10-3-5-11(6-4-10)18-14(19)8-13(15(20)21)17-9-12-2-1-7-22-12/h1-7,13,17H,8-9H2,(H,18,19)(H,20,21)