2-[[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylamino]terephthalic acid

Systemtic Name: 2-[[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylamino]terephthalic acid Openeye Name: 2-[[3-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]amino]terephthalic acid CAS Name: 2-[[oxo-[3-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]amino]terephthalic acid IUPAC Name: 2-[[3-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]amino]terephthalic acid Traditional Name: 2-[[3-[(2-ketopyrrolidino)methyl]benzoyl]amino]terephthalic acid Formula: C20H18N2O6 MolecularWeight: 382.36672

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(=O)O)C(=O)O

InChI

InChI=1S/C20H18N2O6/c23-17-5-2-8-22(17)11-12-3-1-4-13(9-12)18(24)21-16-10-14(19(25)26)6-7-15(16)20(27)28/h1,3-4,6-7,9-10H,2,5,8,11H2,(H,21,24)(H,25,26)(H,27,28)