(2R)-2-(1-oxidanylidenepiperidin-1-ium-2-yl)-3-quinolin-3-yl-propanoic acid

Systemtic Name: (2R)-2-(1-oxidanylidenepiperidin-1-ium-2-yl)-3-quinolin-3-yl-propanoic acid Openeye Name: (2R)-2-(1-oxopiperidin-1-ium-2-yl)-3-(3-quinolyl)propanoic acid CAS Name: (2R)-2-(1-oxo-2-piperidin-1-iumyl)-3-(3-quinolinyl)propanoic acid IUPAC Name: (2R)-2-(1-oxopiperidin-1-ium-2-yl)-3-quinolin-3-ylpropanoic acid Traditional Name: (2R)-2-(1-ketopiperidin-1-ium-2-yl)-3-(3-quinolyl)propionic acid Formula: C17H19N2O3+ MolecularWeight: 299.34436

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](=O)C(C1)C(CC2=CC3=CC=CC=C3N=C2)C(=O)O

Isomeric SMILES

C1CC[N+](=O)C(C1)[C@@H](CC2=CC3=CC=CC=C3N=C2)C(=O)O

InChI

InChI=1S/C17H18N2O3/c20-17(21)14(16-7-3-4-8-19(16)22)10-12-9-13-5-1-2-6-15(13)18-11-12/h1-2,5-6,9,11,14,16H,3-4,7-8,10H2/p+1/t14-,16?/m1/s1