8-ethyl-2-(4-propoxyphenyl)quinoline-4-carboxylic acid

Systemtic Name: 8-ethyl-2-(4-propoxyphenyl)quinoline-4-carboxylic acid Openeye Name: 8-ethyl-2-(4-propoxyphenyl)quinoline-4-carboxylic acid CAS Name: 8-ethyl-2-(4-propoxyphenyl)-4-quinolinecarboxylic acid IUPAC Name: 8-ethyl-2-(4-propoxyphenyl)quinoline-4-carboxylic acid Traditional Name: 8-ethyl-2-(4-propoxyphenyl)cinchoninic acid Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC3=C(C=CC=C3CC)C(=C2)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC3=C(C=CC=C3CC)C(=C2)C(=O)O

InChI

InChI=1S/C21H21NO3/c1-3-12-25-16-10-8-15(9-11-16)19-13-18(21(23)24)17-7-5-6-14(4-2)20(17)22-19/h5-11,13H,3-4,12H2,1-2H3,(H,23,24)