2-(furan-2-yl)quinoline-4-carboxylic acid; (4-methylphenyl)methanamine

Systemtic Name: 2-(furan-2-yl)quinoline-4-carboxylic acid; (4-methylphenyl)methanamine Openeye Name: 2-(2-furyl)quinoline-4-carboxylic acid; p-tolylmethanamine CAS Name: 2-(2-furanyl)-4-quinolinecarboxylic acid; (4-methylphenyl)methanamine IUPAC Name: 2-(furan-2-yl)quinoline-4-carboxylic acid; (4-methylphenyl)methanamine Traditional Name: 2-(2-furyl)cinchoninic acid; (4-methylbenzyl)amine Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN.C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CO3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CN.C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CO3)C(=O)O

InChI

InChI=1S/C14H9NO3.C8H11N/c16-14(17)10-8-12(13-6-3-7-18-13)15-11-5-2-1-4-9(10)11;1-7-2-4-8(6-9)5-3-7/h1-8H,(H,16,17);2-5H,6,9H2,1H3