(4-fluorophenyl)methanamine; 2-(3-methylphenyl)quinoline-4-carboxylic acid

Systemtic Name: (4-fluorophenyl)methanamine; 2-(3-methylphenyl)quinoline-4-carboxylic acid Openeye Name: (4-fluorophenyl)methanamine; 2-(m-tolyl)quinoline-4-carboxylic acid CAS Name: (4-fluorophenyl)methanamine; 2-(3-methylphenyl)-4-quinolinecarboxylic acid IUPAC Name: (4-fluorophenyl)methanamine; 2-(3-methylphenyl)quinoline-4-carboxylic acid Traditional Name: (4-fluorobenzyl)amine; 2-(m-tolyl)cinchoninic acid Formula: C24H21FN2O2 MolecularWeight: 388.434143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O.C1=CC(=CC=C1CN)F

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O.C1=CC(=CC=C1CN)F

InChI

InChI=1S/C17H13NO2.C7H8FN/c1-11-5-4-6-12(9-11)16-10-14(17(19)20)13-7-2-3-8-15(13)18-16;8-7-3-1-6(5-9)2-4-7/h2-10H,1H3,(H,19,20);1-4H,5,9H2