(3S)-1-[2-oxidanylidene-2-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)ethyl]piperidine-3-carboxylic acid

Systemtic Name: (3S)-1-[2-oxidanylidene-2-(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)ethyl]piperidine-3-carboxylic acid Openeye Name: (3S)-1-[2-oxo-2-(2-oxo-3H-1,3-benzoxazol-6-yl)ethyl]piperidine-3-carboxylic acid CAS Name: (3S)-1-[2-oxo-2-(2-oxo-3H-1,3-benzoxazol-6-yl)ethyl]-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-[2-oxo-2-(2-oxo-3H-1,3-benzoxazol-6-yl)ethyl]piperidine-3-carboxylic acid Traditional Name: (3S)-1-[2-keto-2-(2-keto-3H-1,3-benzoxazol-6-yl)ethyl]nipecotic acid Formula: C15H16N2O5 MolecularWeight: 304.29794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)C2=CC3=C(C=C2)NC(=O)O3)C(=O)O

Isomeric SMILES

C1C[C@@H](CN(C1)CC(=O)C2=CC3=C(C=C2)NC(=O)O3)C(=O)O

InChI

InChI=1S/C15H16N2O5/c18-12(8-17-5-1-2-10(7-17)14(19)20)9-3-4-11-13(6-9)22-15(21)16-11/h3-4,6,10H,1-2,5,7-8H2,(H,16,21)(H,19,20)/t10-/m0/s1