3-[[(3R)-1-(4-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: 3-[[(3R)-1-(4-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: 3-[[(3R)-1-(4-bromophenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 3-[[[(3R)-1-(4-bromophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoate IUPAC Name: 3-[[(3R)-1-(4-bromophenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 3-[[(3R)-1-(4-bromophenyl)-5-keto-pyrrolidine-3-carbonyl]amino]benzoate Formula: C18H14BrN2O4- MolecularWeight: 402.21876

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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

C1[C@H](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)/p-1/t12-/m1/s1