2-methyl-3-(thiophen-2-ylmethylamino)benzoate

Systemtic Name: 2-methyl-3-(thiophen-2-ylmethylamino)benzoate Openeye Name: 2-methyl-3-(2-thienylmethylamino)benzoate CAS Name: 2-methyl-3-(thiophen-2-ylmethylamino)benzoate IUPAC Name: 2-methyl-3-(thiophen-2-ylmethylamino)benzoate Traditional Name: 2-methyl-3-(2-thenylamino)benzoate Formula: C13H12NO2S- MolecularWeight: 246.30488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC2=CC=CS2)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1NCC2=CC=CS2)C(=O)[O-]

InChI

InChI=1S/C13H13NO2S/c1-9-11(13(15)16)5-2-6-12(9)14-8-10-4-3-7-17-10/h2-7,14H,8H2,1H3,(H,15,16)/p-1