2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-4-(2-bromanylethanoylamino)benzoate

Systemtic Name: 2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-4-(2-bromanylethanoylamino)benzoate Openeye Name: 4-[(2-bromoacetyl)amino]-2-(2,5-dioxopyrrolidin-1-yl)benzoate CAS Name: 4-[(2-bromo-1-oxoethyl)amino]-2-(2,5-dioxo-1-pyrrolidinyl)benzoate IUPAC Name: 4-[(2-bromoacetyl)amino]-2-(2,5-dioxopyrrolidin-1-yl)benzoate Traditional Name: 4-[(2-bromoacetyl)amino]-2-succinimido-benzoate Formula: C13H10BrN2O5- MolecularWeight: 354.1329

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)C2=C(C=CC(=C2)NC(=O)CBr)C(=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1=O)C2=C(C=CC(=C2)NC(=O)CBr)C(=O)[O-]

InChI

InChI=1S/C13H11BrN2O5/c14-6-10(17)15-7-1-2-8(13(20)21)9(5-7)16-11(18)3-4-12(16)19/h1-2,5H,3-4,6H2,(H,15,17)(H,20,21)/p-1