3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-2-methyl-benzoic acid

Systemtic Name: 3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-2-methyl-benzoic acid Openeye Name: 3-[1-(2,5-dimethyl-3-thienyl)ethylamino]-2-methyl-benzoic acid CAS Name: 3-[1-(2,5-dimethyl-3-thiophenyl)ethylamino]-2-methylbenzoic acid IUPAC Name: 3-[1-(2,5-dimethylthiophen-3-yl)ethylamino]-2-methylbenzoic acid Traditional Name: 3-[1-(2,5-dimethyl-3-thienyl)ethylamino]-2-methyl-benzoic acid Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(C)NC2=CC=CC(=C2C)C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)C)C(C)NC2=CC=CC(=C2C)C(=O)O

InChI

InChI=1S/C16H19NO2S/c1-9-8-14(12(4)20-9)11(3)17-15-7-5-6-13(10(15)2)16(18)19/h5-8,11,17H,1-4H3,(H,18,19)