methyl 5-oxidanylidene-5-[[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-3-yl]amino]pentanoate

Systemtic Name: methyl 5-oxidanylidene-5-[[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-3-yl]amino]pentanoate Openeye Name: methyl 5-oxo-5-[[1-[5-(trifluoromethyl)-2-pyridyl]-3-piperidyl]amino]pentanoate CAS Name: 5-oxo-5-[[1-[5-(trifluoromethyl)-2-pyridinyl]-3-piperidinyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 5-oxo-5-[[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-3-yl]amino]pentanoate Traditional Name: 5-keto-5-[[1-[5-(trifluoromethyl)-2-pyridyl]-3-piperidyl]amino]valeric acid methyl ester Formula: C17H22F3N3O3 MolecularWeight: 373.37009

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)NC1CCCN(C1)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

COC(=O)CCCC(=O)NC1CCCN(C1)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H22F3N3O3/c1-26-16(25)6-2-5-15(24)22-13-4-3-9-23(11-13)14-8-7-12(10-21-14)17(18,19)20/h7-8,10,13H,2-6,9,11H2,1H3,(H,22,24)