N-cyclopropyl-3-[(3S)-1-(quinolin-8-ylmethyl)piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-cyclopropyl-3-[(3S)-1-(quinolin-8-ylmethyl)piperidin-1-ium-3-yl]propanamide Openeye Name: N-cyclopropyl-3-[(3S)-1-(8-quinolylmethyl)piperidin-1-ium-3-yl]propanamide CAS Name: N-cyclopropyl-3-[(3S)-1-(8-quinolinylmethyl)-3-piperidin-1-iumyl]propanamide IUPAC Name: N-cyclopropyl-3-[(3S)-1-(quinolin-8-ylmethyl)piperidin-1-ium-3-yl]propanamide Traditional Name: N-cyclopropyl-3-[(3S)-1-(8-quinolylmethyl)piperidin-1-ium-3-yl]propionamide Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC3=C2N=CC=C3)CCC(=O)NC4CC4

Isomeric SMILES

C1C[C@H](C[NH+](C1)CC2=CC=CC3=C2N=CC=C3)CCC(=O)NC4CC4

InChI

InChI=1S/C21H27N3O/c25-20(23-19-9-10-19)11-8-16-4-3-13-24(14-16)15-18-6-1-5-17-7-2-12-22-21(17)18/h1-2,5-7,12,16,19H,3-4,8-11,13-15H2,(H,23,25)/p+1/t16-/m0/s1