methyl 2-[[(3R)-piperidin-1-ium-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[(3R)-piperidin-1-ium-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[(3R)-piperidin-1-ium-3-carbonyl]amino]benzoate CAS Name: 2-[[oxo-[(3R)-3-piperidin-1-iumyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3R)-piperidin-1-ium-3-carbonyl]amino]benzoate Traditional Name: 2-[[(3R)-piperidin-1-ium-3-carbonyl]amino]benzoic acid methyl ester Formula: C14H19N2O3+ MolecularWeight: 263.31226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2CCC[NH2+]C2

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)[C@@H]2CCC[NH2+]C2

InChI

InChI=1S/C14H18N2O3/c1-19-14(18)11-6-2-3-7-12(11)16-13(17)10-5-4-8-15-9-10/h2-3,6-7,10,15H,4-5,8-9H2,1H3,(H,16,17)/p+1/t10-/m1/s1