6-[(2R)-2-pyridin-1-ium-4-ylpyrrolidin-1-yl]pyridine-3-carboxylic acid

Systemtic Name: 6-[(2R)-2-pyridin-1-ium-4-ylpyrrolidin-1-yl]pyridine-3-carboxylic acid Openeye Name: 6-[(2R)-2-pyridin-1-ium-4-ylpyrrolidin-1-yl]pyridine-3-carboxylic acid CAS Name: 6-[(2R)-2-(4-pyridin-1-iumyl)-1-pyrrolidinyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[(2R)-2-pyridin-1-ium-4-ylpyrrolidin-1-yl]pyridine-3-carboxylic acid Traditional Name: 6-[(2R)-2-pyridin-1-ium-4-ylpyrrolidino]nicotinic acid Formula: C15H16N3O2+ MolecularWeight: 270.30644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=C(C=C2)C(=O)O)C3=CC=[NH+]C=C3

Isomeric SMILES

C1C[C@@H](N(C1)C2=NC=C(C=C2)C(=O)O)C3=CC=[NH+]C=C3

InChI

InChI=1S/C15H15N3O2/c19-15(20)12-3-4-14(17-10-12)18-9-1-2-13(18)11-5-7-16-8-6-11/h3-8,10,13H,1-2,9H2,(H,19,20)/p+1/t13-/m1/s1