2-methyl-2-(3-methyl-5-oxidanylidene-4-thiophen-3-yl-2H-pyrrol-1-yl)propanoic acid

Systemtic Name: 2-methyl-2-(3-methyl-5-oxidanylidene-4-thiophen-3-yl-2H-pyrrol-1-yl)propanoic acid Openeye Name: 2-methyl-2-[3-methyl-5-oxo-4-(3-thienyl)-2H-pyrrol-1-yl]propanoic acid CAS Name: 2-methyl-2-[3-methyl-5-oxo-4-(3-thiophenyl)-2H-pyrrol-1-yl]propanoic acid IUPAC Name: 2-methyl-2-(3-methyl-5-oxo-4-thiophen-3-yl-2H-pyrrol-1-yl)propanoic acid Traditional Name: 2-[2-keto-4-methyl-3-(3-thienyl)-3-pyrrolin-1-yl]-2-methyl-propionic acid Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C1)C(C)(C)C(=O)O)C2=CSC=C2

Isomeric SMILES

CC1=C(C(=O)N(C1)C(C)(C)C(=O)O)C2=CSC=C2

InChI

InChI=1S/C13H15NO3S/c1-8-6-14(13(2,3)12(16)17)11(15)10(8)9-4-5-18-7-9/h4-5,7H,6H2,1-3H3,(H,16,17)