2-oxidanyl-2-(1,2,3,4-tetrahydroquinolin-6-yl)propanedioic acid

Systemtic Name: 2-oxidanyl-2-(1,2,3,4-tetrahydroquinolin-6-yl)propanedioic acid Openeye Name: 2-hydroxy-2-(1,2,3,4-tetrahydroquinolin-6-yl)propanedioic acid CAS Name: 2-hydroxy-2-(1,2,3,4-tetrahydroquinolin-6-yl)propanedioic acid IUPAC Name: 2-hydroxy-2-(1,2,3,4-tetrahydroquinolin-6-yl)propanedioic acid Traditional Name: 2-hydroxy-2-(1,2,3,4-tetrahydroquinolin-6-yl)malonic acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(C(=O)O)(C(=O)O)O)NC1

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(C(=O)O)(C(=O)O)O)NC1

InChI

InChI=1S/C12H13NO5/c14-10(15)12(18,11(16)17)8-3-4-9-7(6-8)2-1-5-13-9/h3-4,6,13,18H,1-2,5H2,(H,14,15)(H,16,17)