9-butan-2-yl-3-(hydroxymethyl)-5H-thiochromeno[4,3-b]pyran-4-one

Systemtic Name: 9-butan-2-yl-3-(hydroxymethyl)-5H-thiochromeno[4,3-b]pyran-4-one Openeye Name: 3-(hydroxymethyl)-9-sec-butyl-5H-thiochromeno[4,3-b]pyran-4-one CAS Name: 9-butan-2-yl-3-(hydroxymethyl)-5H-thiochromeno[4,3-b]pyran-4-one IUPAC Name: 9-butan-2-yl-3-(hydroxymethyl)-5H-thiochromeno[4,3-b]pyran-4-one Traditional Name: 3-methylol-9-sec-butyl-5H-thiochromeno[4,3-b]pyran-4-one Formula: C17H18O3S MolecularWeight: 302.38802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)SCC3=C2OC=C(C3=O)CO

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)SCC3=C2OC=C(C3=O)CO

InChI

InChI=1S/C17H18O3S/c1-3-10(2)11-4-5-15-13(6-11)17-14(9-21-15)16(19)12(7-18)8-20-17/h4-6,8,10,18H,3,7,9H2,1-2H3