4-methyl-5-propan-2-yl-2-pyrrol-1-yl-thiophene-3-carboxylic acid

Systemtic Name: 4-methyl-5-propan-2-yl-2-pyrrol-1-yl-thiophene-3-carboxylic acid Openeye Name: 5-isopropyl-4-methyl-2-pyrrol-1-yl-thiophene-3-carboxylic acid CAS Name: 4-methyl-5-propan-2-yl-2-(1-pyrrolyl)-3-thiophenecarboxylic acid IUPAC Name: 4-methyl-5-propan-2-yl-2-pyrrol-1-ylthiophene-3-carboxylic acid Traditional Name: 5-isopropyl-4-methyl-2-pyrrol-1-yl-3-thenoic acid Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)O)N2C=CC=C2)C(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)O)N2C=CC=C2)C(C)C

InChI

InChI=1S/C13H15NO2S/c1-8(2)11-9(3)10(13(15)16)12(17-11)14-6-4-5-7-14/h4-8H,1-3H3,(H,15,16)