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

Systemtic Name: 3-[[1-(4-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoic acid Openeye Name: 3-[[1-(4-bromophenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoic acid CAS Name: 3-[[[1-(4-bromophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[1-(4-bromophenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoic acid Traditional Name: 3-[[1-(4-bromophenyl)-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid Formula: C18H15BrN2O4 MolecularWeight: 403.2267

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrN2O4/c19-13-4-6-15(7-5-13)21-10-12(9-16(21)22)17(23)20-14-3-1-2-11(8-14)18(24)25/h1-8,12H,9-10H2,(H,20,23)(H,24,25)