ethyl 1-[(4-fluorophenyl)methyl]-5-methyl-4-nitro-pyrrole-2-carboxylate

Systemtic Name: ethyl 1-[(4-fluorophenyl)methyl]-5-methyl-4-nitro-pyrrole-2-carboxylate Openeye Name: ethyl 1-[(4-fluorophenyl)methyl]-5-methyl-4-nitro-pyrrole-2-carboxylate CAS Name: 1-[(4-fluorophenyl)methyl]-5-methyl-4-nitro-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-fluorophenyl)methyl]-5-methyl-4-nitropyrrole-2-carboxylate Traditional Name: 1-(4-fluorobenzyl)-5-methyl-4-nitro-pyrrole-2-carboxylic acid ethyl ester Formula: C15H15FN2O4 MolecularWeight: 306.289003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N1CC2=CC=C(C=C2)F)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(N1CC2=CC=C(C=C2)F)C)[N+](=O)[O-]

InChI

InChI=1S/C15H15FN2O4/c1-3-22-15(19)14-8-13(18(20)21)10(2)17(14)9-11-4-6-12(16)7-5-11/h4-8H,3,9H2,1-2H3