(4-fluorophenyl)methanamine; 2-(4-methoxyphenyl)quinoline-4-carboxylic acid

Systemtic Name: (4-fluorophenyl)methanamine; 2-(4-methoxyphenyl)quinoline-4-carboxylic acid Openeye Name: (4-fluorophenyl)methanamine; 2-(4-methoxyphenyl)quinoline-4-carboxylic acid CAS Name: (4-fluorophenyl)methanamine; 2-(4-methoxyphenyl)-4-quinolinecarboxylic acid IUPAC Name: (4-fluorophenyl)methanamine; 2-(4-methoxyphenyl)quinoline-4-carboxylic acid Traditional Name: (4-fluorobenzyl)amine; 2-(4-methoxyphenyl)cinchoninic acid Formula: C24H21FN2O3 MolecularWeight: 404.433543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O.C1=CC(=CC=C1CN)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O.C1=CC(=CC=C1CN)F

InChI

InChI=1S/C17H13NO3.C7H8FN/c1-21-12-8-6-11(7-9-12)16-10-14(17(19)20)13-4-2-3-5-15(13)18-16;8-7-3-1-6(5-9)2-4-7/h2-10H,1H3,(H,19,20);1-4H,5,9H2