5-[[(2-methylphenyl)methylamino]methyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[[(2-methylphenyl)methylamino]methyl]thiophene-2-carboxylic acid Openeye Name: 5-[(o-tolylmethylamino)methyl]thiophene-2-carboxylic acid CAS Name: 5-[[(2-methylphenyl)methylamino]methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[[(2-methylphenyl)methylamino]methyl]thiophene-2-carboxylic acid Traditional Name: 5-[[(2-methylbenzyl)amino]methyl]-2-thenoic acid Formula: C14H15NO2S MolecularWeight: 261.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNCC2=CC=C(S2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CNCC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C14H15NO2S/c1-10-4-2-3-5-11(10)8-15-9-12-6-7-13(18-12)14(16)17/h2-7,15H,8-9H2,1H3,(H,16,17)