3-fluoranyl-4-[methyl-[(4-methylphenyl)methyl]amino]benzoic acid

Systemtic Name: 3-fluoranyl-4-[methyl-[(4-methylphenyl)methyl]amino]benzoic acid Openeye Name: 3-fluoro-4-[methyl(p-tolylmethyl)amino]benzoic acid CAS Name: 3-fluoro-4-[methyl-[(4-methylphenyl)methyl]amino]benzoic acid IUPAC Name: 3-fluoro-4-[methyl-[(4-methylphenyl)methyl]amino]benzoic acid Traditional Name: 3-fluoro-4-[methyl-(4-methylbenzyl)amino]benzoic acid Formula: C16H16FNO2 MolecularWeight: 273.302143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C)C2=C(C=C(C=C2)C(=O)O)F

Isomeric SMILES

CC1=CC=C(C=C1)CN(C)C2=C(C=C(C=C2)C(=O)O)F

InChI

InChI=1S/C16H16FNO2/c1-11-3-5-12(6-4-11)10-18(2)15-8-7-13(16(19)20)9-14(15)17/h3-9H,10H2,1-2H3,(H,19,20)