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

Systemtic Name: 5-[[(4-methylphenyl)methyl-(phenylmethyl)amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[[benzyl(p-tolylmethyl)amino]methyl]furan-2-carboxylic acid CAS Name: 5-[[(4-methylphenyl)methyl-(phenylmethyl)amino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[benzyl-[(4-methylphenyl)methyl]amino]methyl]furan-2-carboxylic acid Traditional Name: 5-[[benzyl-(4-methylbenzyl)amino]methyl]-2-furoic acid Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO3/c1-16-7-9-18(10-8-16)14-22(13-17-5-3-2-4-6-17)15-19-11-12-20(25-19)21(23)24/h2-12H,13-15H2,1H3,(H,23,24)