(2R)-2-(3-methylpyridin-1-ium-1-yl)-3-oxidanyl-propanoic acid

Systemtic Name: (2R)-2-(3-methylpyridin-1-ium-1-yl)-3-oxidanyl-propanoic acid Openeye Name: (2R)-3-hydroxy-2-(3-methylpyridin-1-ium-1-yl)propanoic acid CAS Name: (2R)-3-hydroxy-2-(3-methyl-1-pyridin-1-iumyl)propanoic acid IUPAC Name: (2R)-3-hydroxy-2-(3-methylpyridin-1-ium-1-yl)propanoic acid Traditional Name: (2R)-3-hydroxy-2-(3-methylpyridin-1-ium-1-yl)propionic acid Formula: C9H12NO3+ MolecularWeight: 182.19648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C(CO)C(=O)O

Isomeric SMILES

CC1=C[N+](=CC=C1)[C@H](CO)C(=O)O

InChI

InChI=1S/C9H11NO3/c1-7-3-2-4-10(5-7)8(6-11)9(12)13/h2-5,8,11H,6H2,1H3/p+1/t8-/m1/s1