[2-oxidanylidene-2-[[2-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl] 2-azanyl-5-bromanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]ethyl] 2-azanyl-5-bromanyl-benzoate Openeye Name: [2-oxo-2-[2-(2-oxopyrrolidin-1-yl)anilino]ethyl] 2-amino-5-bromo-benzoate CAS Name: 2-amino-5-bromobenzoic acid [2-oxo-2-[2-(2-oxo-1-pyrrolidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(2-oxopyrrolidin-1-yl)anilino]ethyl] 2-amino-5-bromobenzoate Traditional Name: 2-amino-5-bromo-benzoic acid [2-keto-2-[2-(2-ketopyrrolidino)anilino]ethyl] ester Formula: C19H18BrN3O4 MolecularWeight: 432.26792

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC=C2NC(=O)COC(=O)C3=C(C=CC(=C3)Br)N

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC=C2NC(=O)COC(=O)C3=C(C=CC(=C3)Br)N

InChI

InChI=1S/C19H18BrN3O4/c20-12-7-8-14(21)13(10-12)19(26)27-11-17(24)22-15-4-1-2-5-16(15)23-9-3-6-18(23)25/h1-2,4-5,7-8,10H,3,6,9,11,21H2,(H,22,24)