4-[1-[(2S)-butan-2-yl]piperidin-1-ium-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 4-[1-[(2S)-butan-2-yl]piperidin-1-ium-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 4-[1-[(1S)-1-methylpropyl]piperidin-1-ium-4-yl]oxy-N-(2-pyridylmethyl)benzamide CAS Name: 4-[[1-[(2S)-butan-2-yl]-4-piperidin-1-iumyl]oxy]-N-(2-pyridinylmethyl)benzamide IUPAC Name: 4-[1-[(2S)-butan-2-yl]piperidin-1-ium-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-[1-[(1S)-1-methylpropyl]piperidin-1-ium-4-yl]oxy-N-(2-pyridylmethyl)benzamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+]1CCC(CC1)OC2=CC=C(C=C2)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CC[C@H](C)[NH+]1CCC(CC1)OC2=CC=C(C=C2)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C22H29N3O2/c1-3-17(2)25-14-11-21(12-15-25)27-20-9-7-18(8-10-20)22(26)24-16-19-6-4-5-13-23-19/h4-10,13,17,21H,3,11-12,14-16H2,1-2H3,(H,24,26)/p+1/t17-/m0/s1