methyl 5-[(3S)-3-[(3-fluorophenyl)amino]piperidin-1-yl]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-[(3S)-3-[(3-fluorophenyl)amino]piperidin-1-yl]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-[(3S)-3-(3-fluoroanilino)-1-piperidyl]-5-oxo-pentanoate CAS Name: 5-[(3S)-3-(3-fluoroanilino)-1-piperidinyl]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-[(3S)-3-(3-fluoroanilino)piperidin-1-yl]-5-oxopentanoate Traditional Name: 5-[(3S)-3-(3-fluoroanilino)piperidino]-5-keto-valeric acid methyl ester Formula: C17H23FN2O3 MolecularWeight: 322.374523

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)N1CCCC(C1)NC2=CC(=CC=C2)F

Isomeric SMILES

COC(=O)CCCC(=O)N1CCC[C@@H](C1)NC2=CC(=CC=C2)F

InChI

InChI=1S/C17H23FN2O3/c1-23-17(22)9-3-8-16(21)20-10-4-7-15(12-20)19-14-6-2-5-13(18)11-14/h2,5-6,11,15,19H,3-4,7-10,12H2,1H3/t15-/m0/s1