(2S)-N-propyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-propyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-propyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propanamide CAS Name: (2S)-N-propyl-2-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2S)-N-propyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-propyl-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)propionamide Formula: C15H26N4O+2 MolecularWeight: 278.39314

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)[NH+]1CCN(CC1)C2=CC=CC=[NH+]2

Isomeric SMILES

CCCNC(=O)[C@H](C)[NH+]1CCN(CC1)C2=CC=CC=[NH+]2

InChI

InChI=1S/C15H24N4O/c1-3-7-17-15(20)13(2)18-9-11-19(12-10-18)14-6-4-5-8-16-14/h4-6,8,13H,3,7,9-12H2,1-2H3,(H,17,20)/p+2/t13-/m0/s1