1-(3-nitrophenyl)ethyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: 1-(3-nitrophenyl)ethyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: 1-(3-nitrophenyl)ethyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid 1-(3-nitrophenyl)ethyl ester IUPAC Name: 1-(3-nitrophenyl)ethyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid 1-(3-nitrophenyl)ethyl ester Formula: C13H11BrN2O4 MolecularWeight: 339.14144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=CC(=CN2)Br

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])OC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C13H11BrN2O4/c1-8(9-3-2-4-11(5-9)16(18)19)20-13(17)12-6-10(14)7-15-12/h2-8,15H,1H3