ethyl 2-[1,4-dimethyl-5-(phenylcarbonyl)pyrrol-2-yl]-2-(2-fluoranyl-4-nitro-phenyl)ethanoate

Systemtic Name: ethyl 2-[1,4-dimethyl-5-(phenylcarbonyl)pyrrol-2-yl]-2-(2-fluoranyl-4-nitro-phenyl)ethanoate Openeye Name: ethyl 2-(5-benzoyl-1,4-dimethyl-pyrrol-2-yl)-2-(2-fluoro-4-nitro-phenyl)acetate CAS Name: 2-(5-benzoyl-1,4-dimethyl-2-pyrrolyl)-2-(2-fluoro-4-nitrophenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(5-benzoyl-1,4-dimethylpyrrol-2-yl)-2-(2-fluoro-4-nitrophenyl)acetate Traditional Name: 2-(5-benzoyl-1,4-dimethyl-pyrrol-2-yl)-2-(2-fluoro-4-nitro-phenyl)acetic acid ethyl ester Formula: C23H21FN2O5 MolecularWeight: 424.421643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C=C(C=C1)[N+](=O)[O-])F)C2=CC(=C(N2C)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C(C1=C(C=C(C=C1)[N+](=O)[O-])F)C2=CC(=C(N2C)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H21FN2O5/c1-4-31-23(28)20(17-11-10-16(26(29)30)13-18(17)24)19-12-14(2)21(25(19)3)22(27)15-8-6-5-7-9-15/h5-13,20H,4H2,1-3H3