ethyl 5-(4-fluorophenyl)carbonyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxylate hydrochloride

Systemtic Name: ethyl 5-(4-fluorophenyl)carbonyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxylate hydrochloride Openeye Name: ethyl 5-(4-fluorobenzoyl)-1-(2-pyridylmethyl)pyrrole-3-carboxylate hydrochloride CAS Name: 5-[(4-fluorophenyl)-oxomethyl]-1-(2-pyridinylmethyl)-3-pyrrolecarboxylic acid ethyl ester hydrochloride IUPAC Name: ethyl 5-(4-fluorobenzoyl)-1-(pyridin-2-ylmethyl)pyrrole-3-carboxylate hydrochloride Traditional Name: 5-(4-fluorobenzoyl)-1-(2-pyridylmethyl)pyrrole-3-carboxylic acid ethyl ester hydrochloride Formula: C20H18ClFN2O3 MolecularWeight: 388.819923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=C1)C(=O)C2=CC=C(C=C2)F)CC3=CC=CC=N3.Cl

Isomeric SMILES

CCOC(=O)C1=CN(C(=C1)C(=O)C2=CC=C(C=C2)F)CC3=CC=CC=N3.Cl

InChI

InChI=1S/C20H17FN2O3.ClH/c1-2-26-20(25)15-11-18(19(24)14-6-8-16(21)9-7-14)23(12-15)13-17-5-3-4-10-22-17;/h3-12H,2,13H2,1H3;1H