2-[(3R,4S)-3-ethyl-1-hexanoyl-piperidin-4-yl]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[(3R,4S)-3-ethyl-1-hexanoyl-piperidin-4-yl]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[(3R,4S)-3-ethyl-1-hexanoyl-4-piperidyl]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[(3R,4S)-3-ethyl-1-(1-oxohexyl)-4-piperidinyl]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[(3R,4S)-3-ethyl-1-hexanoylpiperidin-4-yl]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[(3R,4S)-1-caproyl-3-ethyl-4-piperidyl]-N-(3-pyridylmethyl)acetamide Formula: C21H33N3O2 MolecularWeight: 359.50562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCC(C(C1)CC)CC(=O)NCC2=CN=CC=C2

Isomeric SMILES

CCCCCC(=O)N1CC[C@H]([C@H](C1)CC)CC(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C21H33N3O2/c1-3-5-6-9-21(26)24-12-10-19(18(4-2)16-24)13-20(25)23-15-17-8-7-11-22-14-17/h7-8,11,14,18-19H,3-6,9-10,12-13,15-16H2,1-2H3,(H,23,25)/t18-,19-/m0/s1