2-[[(2S)-butan-2-yl]-(furan-2-ylmethyl)azaniumyl]ethanoate

Systemtic Name: 2-[[(2S)-butan-2-yl]-(furan-2-ylmethyl)azaniumyl]ethanoate Openeye Name: 2-[2-furylmethyl-[(1S)-1-methylpropyl]ammonio]acetate CAS Name: 2-[[(2S)-butan-2-yl]-(2-furanylmethyl)ammonio]acetate IUPAC Name: 2-[[(2S)-butan-2-yl]-(furan-2-ylmethyl)azaniumyl]acetate Traditional Name: 2-[2-furfuryl-[(1S)-1-methylpropyl]ammonio]acetate Formula: C11H17NO3 MolecularWeight: 211.25758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+](CC1=CC=CO1)CC(=O)[O-]

Isomeric SMILES

CC[C@H](C)[NH+](CC1=CC=CO1)CC(=O)[O-]

InChI

InChI=1S/C11H17NO3/c1-3-9(2)12(8-11(13)14)7-10-5-4-6-15-10/h4-6,9H,3,7-8H2,1-2H3,(H,13,14)/t9-/m0/s1