4-[(4-chlorophenyl)methyl-ethyl-amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-chlorophenyl)methyl-ethyl-amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(4-chlorophenyl)methyl-ethyl-amino]-4-oxo-butanoic acid CAS Name: 4-[(4-chlorophenyl)methyl-ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[(4-chlorophenyl)methyl-ethylamino]-4-oxobutanoic acid Traditional Name: 4-[(4-chlorobenzyl)-ethyl-amino]-4-keto-butyric acid Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)Cl)C(=O)CCC(=O)O

Isomeric SMILES

CCN(CC1=CC=C(C=C1)Cl)C(=O)CCC(=O)O

InChI

InChI=1S/C13H16ClNO3/c1-2-15(12(16)7-8-13(17)18)9-10-3-5-11(14)6-4-10/h3-6H,2,7-9H2,1H3,(H,17,18)