4-(4-chlorophenyl)-2-(furan-2-ylmethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-chlorophenyl)-2-(furan-2-ylmethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-chlorophenyl)-2-(2-furylmethylamino)-4-oxo-butanoic acid CAS Name: 4-(4-chlorophenyl)-2-(2-furanylmethylamino)-4-oxobutanoic acid IUPAC Name: 4-(4-chlorophenyl)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid Traditional Name: 4-(4-chlorophenyl)-2-(2-furfurylamino)-4-keto-butyric acid Formula: C15H14ClNO4 MolecularWeight: 307.72896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1=COC(=C1)CNC(CC(=O)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C15H14ClNO4/c16-11-5-3-10(4-6-11)14(18)8-13(15(19)20)17-9-12-2-1-7-21-12/h1-7,13,17H,8-9H2,(H,19,20)