3-(3-methylthiophen-2-yl)-2-oxidanylidene-hex-4-ynoic acid

Systemtic Name: 3-(3-methylthiophen-2-yl)-2-oxidanylidene-hex-4-ynoic acid Openeye Name: 3-(3-methyl-2-thienyl)-2-oxo-hex-4-ynoic acid CAS Name: 3-(3-methyl-2-thiophenyl)-2-oxo-4-hexynoic acid IUPAC Name: 3-(3-methylthiophen-2-yl)-2-oxohex-4-ynoic acid Traditional Name: 2-keto-3-(3-methyl-2-thienyl)hex-4-ynoic acid Formula: C11H10O3S MolecularWeight: 222.2603

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C1=C(C=CS1)C)C(=O)C(=O)O

Isomeric SMILES

CC#CC(C1=C(C=CS1)C)C(=O)C(=O)O

InChI

InChI=1S/C11H10O3S/c1-3-4-8(9(12)11(13)14)10-7(2)5-6-15-10/h5-6,8H,1-2H3,(H,13,14)