2-thiophen-2-yl-3-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]butanoic acid

Systemtic Name: 2-thiophen-2-yl-3-[2,4,5-trimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]butanoic acid Openeye Name: 2-(2-thienyl)-3-(2,4,5-trimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)butanoic acid CAS Name: 2-thiophen-2-yl-3-(2,4,5-trimethyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)butanoic acid IUPAC Name: 2-thiophen-2-yl-3-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)butanoic acid Traditional Name: 3-(3,6-diketo-2,4,5-trimethyl-cyclohexa-1,4-dien-1-yl)-2-(2-thienyl)butyric acid Formula: C17H18O4S MolecularWeight: 318.38742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C)C(C)C(C2=CC=CS2)C(=O)O)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C)C(C)C(C2=CC=CS2)C(=O)O)C

InChI

InChI=1S/C17H18O4S/c1-8-9(2)16(19)13(11(4)15(8)18)10(3)14(17(20)21)12-6-5-7-22-12/h5-7,10,14H,1-4H3,(H,20,21)