ethyl 1-[4-ethyl-1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrrol-2-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-ethyl-1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrrol-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-ethyl-1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrrole-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[4-ethyl-1-[(2-fluorophenyl)methyl]-3,5-dimethyl-2-pyrrolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-ethyl-1-[(2-fluorophenyl)methyl]-3,5-dimethylpyrrole-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[4-ethyl-1-(2-fluorobenzyl)-3,5-dimethyl-pyrrole-2-carbonyl]isonipecotic acid ethyl ester Formula: C24H31FN2O3 MolecularWeight: 414.512943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=C1C)C(=O)N2CCC(CC2)C(=O)OCC)CC3=CC=CC=C3F)C

Isomeric SMILES

CCC1=C(N(C(=C1C)C(=O)N2CCC(CC2)C(=O)OCC)CC3=CC=CC=C3F)C

InChI

InChI=1S/C24H31FN2O3/c1-5-20-16(3)22(27(17(20)4)15-19-9-7-8-10-21(19)25)23(28)26-13-11-18(12-14-26)24(29)30-6-2/h7-10,18H,5-6,11-15H2,1-4H3