4-[2-(3-chlorophenyl)ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(3-chlorophenyl)ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(3-chlorophenyl)ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-(3-chlorophenyl)ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-(3-chlorophenyl)ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-(3-chlorophenyl)ethylamino]-4-keto-butyric acid Formula: C12H14ClNO3 MolecularWeight: 255.69746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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