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

Systemtic Name: 4-chloranyl-3-[(1-ethyl-5-oxidanylidene-pyrrolidin-3-yl)carbonylamino]benzoic acid Openeye Name: 4-chloro-3-[(1-ethyl-5-oxo-pyrrolidine-3-carbonyl)amino]benzoic acid CAS Name: 4-chloro-3-[[(1-ethyl-5-oxo-3-pyrrolidinyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[(1-ethyl-5-oxopyrrolidine-3-carbonyl)amino]benzoic acid Traditional Name: 4-chloro-3-[(1-ethyl-5-keto-pyrrolidine-3-carbonyl)amino]benzoic acid Formula: C14H15ClN2O4 MolecularWeight: 310.7329

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CC1=O)C(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

CCN1CC(CC1=O)C(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C14H15ClN2O4/c1-2-17-7-9(6-12(17)18)13(19)16-11-5-8(14(20)21)3-4-10(11)15/h3-5,9H,2,6-7H2,1H3,(H,16,19)(H,20,21)