ethyl 4-(4-fluorophenyl)-2-methyl-5-[2-oxidanylidene-2-(prop-2-enylamino)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-(4-fluorophenyl)-2-methyl-5-[2-oxidanylidene-2-(prop-2-enylamino)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-(allylamino)-2-oxo-acetyl]-4-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[1,2-dioxo-2-(prop-2-enylamino)ethyl]-4-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-fluorophenyl)-2-methyl-5-[2-oxo-2-(prop-2-enylamino)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(allylamino)-2-keto-acetyl]-4-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C19H19FN2O4 MolecularWeight: 358.363563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)F)C(=O)C(=O)NCC=C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)F)C(=O)C(=O)NCC=C)C

InChI

InChI=1S/C19H19FN2O4/c1-4-10-21-18(24)17(23)16-15(12-6-8-13(20)9-7-12)14(11(3)22-16)19(25)26-5-2/h4,6-9,22H,1,5,10H2,2-3H3,(H,21,24)