sodium 2-[2-oxidanylidene-1-(phenylmethyl)quinolin-4-yl]propanoate

Systemtic Name: sodium 2-[2-oxidanylidene-1-(phenylmethyl)quinolin-4-yl]propanoate Openeye Name: sodium 2-(1-benzyl-2-oxo-4-quinolyl)propanoate CAS Name: sodium 2-[2-oxo-1-(phenylmethyl)-4-quinolinyl]propanoate IUPAC Name: sodium 2-(1-benzyl-2-oxoquinolin-4-yl)propanoate Traditional Name: sodium 2-(1-benzyl-2-keto-4-quinolyl)propionate Formula: C19H16NNaO3 MolecularWeight: 329.32501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=O)N(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C1=CC(=O)N(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)[O-].[Na+]

InChI

InChI=1S/C19H17NO3.Na/c1-13(19(22)23)16-11-18(21)20(12-14-7-3-2-4-8-14)17-10-6-5-9-15(16)17;/h2-11,13H,12H2,1H3,(H,22,23);/q;+1/p-1