2-pentoxyquinoline-4-carboxylate

Systemtic Name: 2-pentoxyquinoline-4-carboxylate Openeye Name: 2-pentoxyquinoline-4-carboxylate CAS Name: 2-pentoxy-4-quinolinecarboxylate IUPAC Name: 2-pentoxyquinoline-4-carboxylate Traditional Name: 2-amoxycinchoninate Formula: C15H16NO3- MolecularWeight: 258.29244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=NC2=CC=CC=C2C(=C1)C(=O)[O-]

Isomeric SMILES

CCCCCOC1=NC2=CC=CC=C2C(=C1)C(=O)[O-]

InChI

InChI=1S/C15H17NO3/c1-2-3-6-9-19-14-10-12(15(17)18)11-7-4-5-8-13(11)16-14/h4-5,7-8,10H,2-3,6,9H2,1H3,(H,17,18)/p-1