6-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]pyridine-3-carboxylic acid

Systemtic Name: 6-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]pyridine-3-carboxylic acid Openeye Name: 6-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]pyridine-3-carboxylic acid CAS Name: 6-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]-3-pyridinecarboxylic acid IUPAC Name: 6-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]pyridine-3-carboxylic acid Traditional Name: 6-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]nicotinic acid Formula: C15H24N3O2+ MolecularWeight: 278.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC2=NC=C(C=C2)C(=O)O

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC2=NC=C(C=C2)C(=O)O

InChI

InChI=1S/C15H23N3O2/c1-12-5-2-3-9-18(12)10-4-8-16-14-7-6-13(11-17-14)15(19)20/h6-7,11-12H,2-5,8-10H2,1H3,(H,16,17)(H,19,20)/p+1/t12-/m0/s1