ethyl 4-[1-[(4-fluorophenyl)methyl]-3-nitro-pyrrol-2-yl]butanoate

Systemtic Name: ethyl 4-[1-[(4-fluorophenyl)methyl]-3-nitro-pyrrol-2-yl]butanoate Openeye Name: ethyl 4-[1-[(4-fluorophenyl)methyl]-3-nitro-pyrrol-2-yl]butanoate CAS Name: 4-[1-[(4-fluorophenyl)methyl]-3-nitro-2-pyrrolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[1-[(4-fluorophenyl)methyl]-3-nitropyrrol-2-yl]butanoate Traditional Name: 4-[1-(4-fluorobenzyl)-3-nitro-pyrrol-2-yl]butyric acid ethyl ester Formula: C17H19FN2O4 MolecularWeight: 334.342163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCC1=C(C=CN1CC2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCC1=C(C=CN1CC2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H19FN2O4/c1-2-24-17(21)5-3-4-15-16(20(22)23)10-11-19(15)12-13-6-8-14(18)9-7-13/h6-11H,2-5,12H2,1H3