N-methyl-3-[(3R)-1-pyridin-1-ium-4-ylpiperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide

Systemtic Name: N-methyl-3-[(3R)-1-pyridin-1-ium-4-ylpiperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide Openeye Name: N-methyl-3-[(3R)-1-pyridin-1-ium-4-yl-3-piperidyl]-N-[2-(2-pyridyl)ethyl]propanamide CAS Name: N-methyl-3-[(3R)-1-(4-pyridin-1-iumyl)-3-piperidinyl]-N-[2-(2-pyridinyl)ethyl]propanamide IUPAC Name: N-methyl-3-[(3R)-1-pyridin-1-ium-4-ylpiperidin-3-yl]-N-(2-pyridin-2-ylethyl)propanamide Traditional Name: N-methyl-3-[(3R)-1-pyridin-1-ium-4-yl-3-piperidyl]-N-[2-(2-pyridyl)ethyl]propionamide Formula: C21H29N4O+ MolecularWeight: 353.48116

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C(=O)CCC2CCCN(C2)C3=CC=[NH+]C=C3

Isomeric SMILES

CN(CCC1=CC=CC=N1)C(=O)CC[C@H]2CCCN(C2)C3=CC=[NH+]C=C3

InChI

InChI=1S/C21H28N4O/c1-24(16-11-19-6-2-3-12-23-19)21(26)8-7-18-5-4-15-25(17-18)20-9-13-22-14-10-20/h2-3,6,9-10,12-14,18H,4-5,7-8,11,15-17H2,1H3/p+1/t18-/m1/s1