8-butoxy-3-methyl-4-oxidanylidene-5H-thiochromeno[4,3-b]pyran-2-carboxylic acid

Systemtic Name: 8-butoxy-3-methyl-4-oxidanylidene-5H-thiochromeno[4,3-b]pyran-2-carboxylic acid Openeye Name: 8-butoxy-3-methyl-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carboxylic acid CAS Name: 8-butoxy-3-methyl-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carboxylic acid IUPAC Name: 8-butoxy-3-methyl-4-oxo-5H-thiochromeno[4,3-b]pyran-2-carboxylic acid Traditional Name: 8-butoxy-4-keto-3-methyl-5H-thiochromeno[4,3-b]pyran-2-carboxylic acid Formula: C18H18O5S MolecularWeight: 346.39752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C3=C(CS2)C(=O)C(=C(O3)C(=O)O)C

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C3=C(CS2)C(=O)C(=C(O3)C(=O)O)C

InChI

InChI=1S/C18H18O5S/c1-3-4-7-22-11-5-6-12-14(8-11)24-9-13-15(19)10(2)16(18(20)21)23-17(12)13/h5-6,8H,3-4,7,9H2,1-2H3,(H,20,21)