[2-[(2-fluorophenyl)carbamoylamino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-[[(2-fluoroanilino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-[(2-fluorophenyl)carbamoylamino]-2-keto-ethyl] ester Formula: C14H11BrFN3O4 MolecularWeight: 384.157243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)NC(=O)COC(=O)C2=CC(=CN2)Br)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)NC(=O)COC(=O)C2=CC(=CN2)Br)F

InChI

InChI=1S/C14H11BrFN3O4/c15-8-5-11(17-6-8)13(21)23-7-12(20)19-14(22)18-10-4-2-1-3-9(10)16/h1-6,17H,7H2,(H2,18,19,20,22)