(2S)-N-methyl-2-piperazin-4-ium-1-yl-N-(2-pyridin-2-ylethyl)propanamide

Systemtic Name: (2S)-N-methyl-2-piperazin-4-ium-1-yl-N-(2-pyridin-2-ylethyl)propanamide Openeye Name: (2S)-N-methyl-2-piperazin-4-ium-1-yl-N-[2-(2-pyridyl)ethyl]propanamide CAS Name: (2S)-N-methyl-2-(1-piperazin-4-iumyl)-N-[2-(2-pyridinyl)ethyl]propanamide IUPAC Name: (2S)-N-methyl-2-piperazin-4-ium-1-yl-N-(2-pyridin-2-ylethyl)propanamide Traditional Name: (2S)-N-methyl-2-piperazin-4-ium-1-yl-N-[2-(2-pyridyl)ethyl]propionamide Formula: C15H25N4O+ MolecularWeight: 277.3852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CCC1=CC=CC=N1)N2CC[NH2+]CC2

Isomeric SMILES

C[C@@H](C(=O)N(C)CCC1=CC=CC=N1)N2CC[NH2+]CC2

InChI

InChI=1S/C15H24N4O/c1-13(19-11-8-16-9-12-19)15(20)18(2)10-6-14-5-3-4-7-17-14/h3-5,7,13,16H,6,8-12H2,1-2H3/p+1/t13-/m0/s1