2-[(7-chloranylquinolin-3-yl)methyl]-2-oxidanyl-propanedioic acid

Systemtic Name: 2-[(7-chloranylquinolin-3-yl)methyl]-2-oxidanyl-propanedioic acid Openeye Name: 2-[(7-chloro-3-quinolyl)methyl]-2-hydroxy-propanedioic acid CAS Name: 2-[(7-chloro-3-quinolinyl)methyl]-2-hydroxypropanedioic acid IUPAC Name: 2-[(7-chloroquinolin-3-yl)methyl]-2-hydroxypropanedioic acid Traditional Name: 2-[(7-chloro-3-quinolyl)methyl]-2-hydroxy-malonic acid Formula: C13H10ClNO5 MolecularWeight: 295.6752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=NC=C(C=C21)CC(C(=O)O)(C(=O)O)O)Cl

Isomeric SMILES

C1=CC(=CC2=NC=C(C=C21)CC(C(=O)O)(C(=O)O)O)Cl

InChI

InChI=1S/C13H10ClNO5/c14-9-2-1-8-3-7(6-15-10(8)4-9)5-13(20,11(16)17)12(18)19/h1-4,6,20H,5H2,(H,16,17)(H,18,19)