(2S)-N-(furan-2-ylmethyl)-2-piperazin-1-ium-1-yl-propanamide

Systemtic Name: (2S)-N-(furan-2-ylmethyl)-2-piperazin-1-ium-1-yl-propanamide Openeye Name: (2S)-N-(2-furylmethyl)-2-piperazin-1-ium-1-yl-propanamide CAS Name: (2S)-N-(2-furanylmethyl)-2-(1-piperazin-1-iumyl)propanamide IUPAC Name: (2S)-N-(furan-2-ylmethyl)-2-piperazin-1-ium-1-ylpropanamide Traditional Name: (2S)-N-(2-furfuryl)-2-piperazin-1-ium-1-yl-propionamide Formula: C12H20N3O2+ MolecularWeight: 238.3061

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)[NH+]2CCNCC2

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CO1)[NH+]2CCNCC2

InChI

InChI=1S/C12H19N3O2/c1-10(15-6-4-13-5-7-15)12(16)14-9-11-3-2-8-17-11/h2-3,8,10,13H,4-7,9H2,1H3,(H,14,16)/p+1/t10-/m0/s1