2-[[1-(2-chlorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[1-(2-chlorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]terephthalic acid Openeye Name: 2-[[1-(2-chlorophenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]terephthalic acid CAS Name: 2-[[[1-(2-chlorophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[[1-(2-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]amino]terephthalic acid Traditional Name: 2-[[1-(2-chlorophenyl)-5-keto-pyrrolidine-3-carbonyl]amino]terephthalic acid Formula: C19H15ClN2O6 MolecularWeight: 402.7852

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2Cl)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1C(CN(C1=O)C2=CC=CC=C2Cl)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C19H15ClN2O6/c20-13-3-1-2-4-15(13)22-9-11(8-16(22)23)17(24)21-14-7-10(18(25)26)5-6-12(14)19(27)28/h1-7,11H,8-9H2,(H,21,24)(H,25,26)(H,27,28)