2-(hydroxymethyl)-1-methoxy-8-methyl-10H-benzo[b][5,1]benzoxathiocin-12-one

Systemtic Name: 2-(hydroxymethyl)-1-methoxy-8-methyl-10H-benzo[b][5,1]benzoxathiocin-12-one Openeye Name: 2-(hydroxymethyl)-1-methoxy-8-methyl-10H-benzo[b][5,1]benzoxathiocin-12-one CAS Name: 2-(hydroxymethyl)-1-methoxy-8-methyl-10H-benzo[b][5,1]benzoxathiocin-12-one IUPAC Name: 2-(hydroxymethyl)-1-methoxy-8-methyl-10H-benzo[b][5,1]benzoxathiocin-12-one Traditional Name: 1-methoxy-8-methyl-2-methylol-10H-benzo[b][5,1]benzoxathiocin-12-one Formula: C17H16O4S MolecularWeight: 316.37154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)SC3=C(C(=C(C=C3)CO)OC)C(=O)OC2

Isomeric SMILES

CC1=CC2=C(C=C1)SC3=C(C(=C(C=C3)CO)OC)C(=O)OC2

InChI

InChI=1S/C17H16O4S/c1-10-3-5-13-12(7-10)9-21-17(19)15-14(22-13)6-4-11(8-18)16(15)20-2/h3-7,18H,8-9H2,1-2H3