ethyl 1-[2-[2-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-[2-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-[2-(4-fluorophenyl)ethylamino]-2-oxo-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[2-[2-(4-fluorophenyl)ethylamino]-2-keto-ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C19H23FN2O3 MolecularWeight: 346.395923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)NCCC2=CC=C(C=C2)F)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)NCCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C19H23FN2O3/c1-4-25-19(24)17-11-13(2)22(14(17)3)12-18(23)21-10-9-15-5-7-16(20)8-6-15/h5-8,11H,4,9-10,12H2,1-3H3,(H,21,23)