2-(2-oxidanylideneethyl)-3-quinolin-3-yl-pentanedioic acid

Systemtic Name: 2-(2-oxidanylideneethyl)-3-quinolin-3-yl-pentanedioic acid Openeye Name: 2-(2-oxoethyl)-3-(3-quinolyl)pentanedioic acid CAS Name: 2-(2-oxoethyl)-3-(3-quinolinyl)pentanedioic acid IUPAC Name: 2-(2-oxoethyl)-3-quinolin-3-ylpentanedioic acid Traditional Name: 2-(2-ketoethyl)-3-(3-quinolyl)glutaric acid Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)C(CC(=O)O)C(CC=O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)C(CC(=O)O)C(CC=O)C(=O)O

InChI

InChI=1S/C16H15NO5/c18-6-5-12(16(21)22)13(8-15(19)20)11-7-10-3-1-2-4-14(10)17-9-11/h1-4,6-7,9,12-13H,5,8H2,(H,19,20)(H,21,22)