2-(4-butoxyphenyl)quinoline-4-carboxylate

Systemtic Name: 2-(4-butoxyphenyl)quinoline-4-carboxylate Openeye Name: 2-(4-butoxyphenyl)quinoline-4-carboxylate CAS Name: 2-(4-butoxyphenyl)-4-quinolinecarboxylate IUPAC Name: 2-(4-butoxyphenyl)quinoline-4-carboxylate Traditional Name: 2-(4-butoxyphenyl)cinchoninate Formula: C20H18NO3- MolecularWeight: 320.36182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)[O-]

InChI

InChI=1S/C20H19NO3/c1-2-3-12-24-15-10-8-14(9-11-15)19-13-17(20(22)23)16-6-4-5-7-18(16)21-19/h4-11,13H,2-3,12H2,1H3,(H,22,23)/p-1