4-chloranyl-3-[(1-methyl-5-oxidanylidene-pyrrolidin-3-yl)carbonylamino]benzoic acid

Systemtic Name: 4-chloranyl-3-[(1-methyl-5-oxidanylidene-pyrrolidin-3-yl)carbonylamino]benzoic acid Openeye Name: 4-chloro-3-[(1-methyl-5-oxo-pyrrolidine-3-carbonyl)amino]benzoic acid CAS Name: 4-chloro-3-[[(1-methyl-5-oxo-3-pyrrolidinyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[(1-methyl-5-oxopyrrolidine-3-carbonyl)amino]benzoic acid Traditional Name: 4-chloro-3-[(5-keto-1-methyl-pyrrolidine-3-carbonyl)amino]benzoic acid Formula: C13H13ClN2O4 MolecularWeight: 296.70632

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(CC1=O)C(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

CN1CC(CC1=O)C(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C13H13ClN2O4/c1-16-6-8(5-11(16)17)12(18)15-10-4-7(13(19)20)2-3-9(10)14/h2-4,8H,5-6H2,1H3,(H,15,18)(H,19,20)