4-[2-(2-chlorophenyl)ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(2-chlorophenyl)ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(2-chlorophenyl)ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-(2-chlorophenyl)ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-(2-chlorophenyl)ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-(2-chlorophenyl)ethylamino]-4-keto-butyric acid Formula: C12H14ClNO3 MolecularWeight: 255.69746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCNC(=O)CCC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CCNC(=O)CCC(=O)O)Cl

InChI

InChI=1S/C12H14ClNO3/c13-10-4-2-1-3-9(10)7-8-14-11(15)5-6-12(16)17/h1-4H,5-8H2,(H,14,15)(H,16,17)