3-(2,4-dimethyl-6-propan-2-yl-pyridin-1-ium-1-yl)propanoic acid

Systemtic Name: 3-(2,4-dimethyl-6-propan-2-yl-pyridin-1-ium-1-yl)propanoic acid Openeye Name: 3-(2-isopropyl-4,6-dimethyl-pyridin-1-ium-1-yl)propanoic acid CAS Name: 3-(2,4-dimethyl-6-propan-2-yl-1-pyridin-1-iumyl)propanoic acid IUPAC Name: 3-(2,4-dimethyl-6-propan-2-ylpyridin-1-ium-1-yl)propanoic acid Traditional Name: 3-(2-isopropyl-4,6-dimethyl-pyridin-1-ium-1-yl)propionic acid Formula: C13H20NO2+ MolecularWeight: 222.3034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO2/c1-9(2)12-8-10(3)7-11(4)14(12)6-5-13(15)16/h7-9H,5-6H2,1-4H3/p+1