5-(2,5-dimethylpyrrol-1-yl)-3-methyl-thiophene-2-carboxylate

Systemtic Name: 5-(2,5-dimethylpyrrol-1-yl)-3-methyl-thiophene-2-carboxylate Openeye Name: 5-(2,5-dimethylpyrrol-1-yl)-3-methyl-thiophene-2-carboxylate CAS Name: 5-(2,5-dimethyl-1-pyrrolyl)-3-methyl-2-thiophenecarboxylate IUPAC Name: 5-(2,5-dimethylpyrrol-1-yl)-3-methylthiophene-2-carboxylate Traditional Name: 5-(2,5-dimethylpyrrol-1-yl)-3-methyl-2-thenoate Formula: C12H12NO2S- MolecularWeight: 234.29418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC(=C(S2)C(=O)[O-])C)C

Isomeric SMILES

CC1=CC=C(N1C2=CC(=C(S2)C(=O)[O-])C)C

InChI

InChI=1S/C12H13NO2S/c1-7-6-10(16-11(7)12(14)15)13-8(2)4-5-9(13)3/h4-6H,1-3H3,(H,14,15)/p-1