5-[[(3-fluorophenyl)methyl-[(4-methylphenyl)methyl]amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[(3-fluorophenyl)methyl-[(4-methylphenyl)methyl]amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[[(3-fluorophenyl)methyl-(p-tolylmethyl)amino]methyl]furan-2-carboxylic acid CAS Name: 5-[[(3-fluorophenyl)methyl-[(4-methylphenyl)methyl]amino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[(3-fluorophenyl)methyl-[(4-methylphenyl)methyl]amino]methyl]furan-2-carboxylic acid Traditional Name: 5-[[(3-fluorobenzyl)-(4-methylbenzyl)amino]methyl]-2-furoic acid Formula: C21H20FNO3 MolecularWeight: 353.386803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC2=CC(=CC=C2)F)CC3=CC=C(O3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC2=CC(=CC=C2)F)CC3=CC=C(O3)C(=O)O

InChI

InChI=1S/C21H20FNO3/c1-15-5-7-16(8-6-15)12-23(13-17-3-2-4-18(22)11-17)14-19-9-10-20(26-19)21(24)25/h2-11H,12-14H2,1H3,(H,24,25)