3-(2-ethylimidazol-1-yl)-1-[(3S)-3-(5-fluoranyl-2-methoxy-phenyl)carbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-(2-ethylimidazol-1-yl)-1-[(3S)-3-(5-fluoranyl-2-methoxy-phenyl)carbonylpiperidin-1-yl]propan-1-one Openeye Name: 3-(2-ethylimidazol-1-yl)-1-[(3S)-3-(5-fluoro-2-methoxy-benzoyl)-1-piperidyl]propan-1-one CAS Name: 3-(2-ethyl-1-imidazolyl)-1-[(3S)-3-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-(2-ethylimidazol-1-yl)-1-[(3S)-3-(5-fluoro-2-methoxybenzoyl)piperidin-1-yl]propan-1-one Traditional Name: 3-(2-ethylimidazol-1-yl)-1-[(3S)-3-(5-fluoro-2-methoxy-benzoyl)piperidino]propan-1-one Formula: C21H26FN3O3 MolecularWeight: 387.447843

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CN1CCC(=O)N2CCCC(C2)C(=O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CCC1=NC=CN1CCC(=O)N2CCC[C@@H](C2)C(=O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C21H26FN3O3/c1-3-19-23-9-12-24(19)11-8-20(26)25-10-4-5-15(14-25)21(27)17-13-16(22)6-7-18(17)28-2/h6-7,9,12-13,15H,3-5,8,10-11,14H2,1-2H3/t15-/m0/s1