(2S)-N-(furan-2-ylmethyl)-2-(4-methylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-(furan-2-ylmethyl)-2-(4-methylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(2-furylmethyl)-2-(4-methylpiperazin-1-ium-1-yl)propanamide CAS Name: (2S)-N-(2-furanylmethyl)-2-(4-methyl-1-piperazin-1-iumyl)propanamide IUPAC Name: (2S)-N-(furan-2-ylmethyl)-2-(4-methylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-(2-furfuryl)-2-(4-methylpiperazin-1-ium-1-yl)propionamide Formula: C13H22N3O2+ MolecularWeight: 252.33268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)[NH+]2CCN(CC2)C

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CO1)[NH+]2CCN(CC2)C

InChI

InChI=1S/C13H21N3O2/c1-11(16-7-5-15(2)6-8-16)13(17)14-10-12-4-3-9-18-12/h3-4,9,11H,5-8,10H2,1-2H3,(H,14,17)/p+1/t11-/m0/s1