3-imidazo[1,2-a]pyridin-2-yl-N-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]propanamide

Systemtic Name: 3-imidazo[1,2-a]pyridin-2-yl-N-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]propanamide Openeye Name: 3-imidazo[1,2-a]pyridin-2-yl-N-[(3S)-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]propanamide CAS Name: 3-(2-imidazo[1,2-a]pyridinyl)-N-[(3S)-1-(2-pyridinylmethyl)-3-piperidin-1-iumyl]propanamide IUPAC Name: 3-imidazo[1,2-a]pyridin-2-yl-N-[(3S)-1-(pyridin-2-ylmethyl)piperidin-1-ium-3-yl]propanamide Traditional Name: 3-imidazo[1,2-a]pyridin-2-yl-N-[(3S)-1-(2-pyridylmethyl)piperidin-1-ium-3-yl]propionamide Formula: C21H26N5O+ MolecularWeight: 364.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=N2)NC(=O)CCC3=CN4C=CC=CC4=N3

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=N2)NC(=O)CCC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C21H25N5O/c27-21(10-9-19-16-26-13-4-2-8-20(26)23-19)24-18-7-5-12-25(15-18)14-17-6-1-3-11-22-17/h1-4,6,8,11,13,16,18H,5,7,9-10,12,14-15H2,(H,24,27)/p+1/t18-/m0/s1