2-[(3,4-dichlorophenyl)methyl-ethanoyl-amino]propanedioic acid

Systemtic Name: 2-[(3,4-dichlorophenyl)methyl-ethanoyl-amino]propanedioic acid Openeye Name: 2-[acetyl-[(3,4-dichlorophenyl)methyl]amino]propanedioic acid CAS Name: 2-[acetyl-[(3,4-dichlorophenyl)methyl]amino]propanedioic acid IUPAC Name: 2-[acetyl-[(3,4-dichlorophenyl)methyl]amino]propanedioic acid Traditional Name: 2-[acetyl-(3,4-dichlorobenzyl)amino]malonic acid Formula: C12H11Cl2NO5 MolecularWeight: 320.12544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CC1=CC(=C(C=C1)Cl)Cl)C(C(=O)O)C(=O)O

Isomeric SMILES

CC(=O)N(CC1=CC(=C(C=C1)Cl)Cl)C(C(=O)O)C(=O)O

InChI

InChI=1S/C12H11Cl2NO5/c1-6(16)15(10(11(17)18)12(19)20)5-7-2-3-8(13)9(14)4-7/h2-4,10H,5H2,1H3,(H,17,18)(H,19,20)