ethyl 5-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethanoyl]-4-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethanoyl]-4-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-acetyl]-4-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-(1,3-benzodioxol-5-ylamino)-1,2-dioxoethyl]-4-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(1,3-benzodioxol-5-ylamino)-2-oxoacetyl]-4-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(1,3-benzodioxol-5-ylamino)-2-keto-acetyl]-4-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H19FN2O6 MolecularWeight: 438.405163

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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)NC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)F)C(=O)C(=O)NC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C23H19FN2O6/c1-3-30-23(29)18-12(2)25-20(19(18)13-4-6-14(24)7-5-13)21(27)22(28)26-15-8-9-16-17(10-15)32-11-31-16/h4-10,25H,3,11H2,1-2H3,(H,26,28)