ethanedioic acid; ethyl 3-azanyl-3-[2,3-bis(chloranyl)phenyl]propanoate

Systemtic Name: ethanedioic acid; ethyl 3-azanyl-3-[2,3-bis(chloranyl)phenyl]propanoate Openeye Name: ethyl 3-amino-3-(2,3-dichlorophenyl)propanoate; oxalic acid CAS Name: 3-amino-3-(2,3-dichlorophenyl)propanoic acid ethyl ester; oxalic acid IUPAC Name: ethyl 3-amino-3-(2,3-dichlorophenyl)propanoate; oxalic acid Traditional Name: 3-amino-3-(2,3-dichlorophenyl)propionic acid ethyl ester; oxalic acid Formula: C13H15Cl2NO6 MolecularWeight: 352.1673

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=C(C(=CC=C1)Cl)Cl)N.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)CC(C1=C(C(=CC=C1)Cl)Cl)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H13Cl2NO2.C2H2O4/c1-2-16-10(15)6-9(14)7-4-3-5-8(12)11(7)13;3-1(4)2(5)6/h3-5,9H,2,6,14H2,1H3;(H,3,4)(H,5,6)