2-[10,10-bis(oxidanylidene)phenoxathiin-2-yl]butan-1-ol

Systemtic Name: 2-[10,10-bis(oxidanylidene)phenoxathiin-2-yl]butan-1-ol Openeye Name: 2-(10,10-dioxophenoxathiin-2-yl)butan-1-ol CAS Name: 2-(10,10-dioxo-2-phenoxathiinyl)-1-butanol IUPAC Name: 2-(10,10-dioxophenoxathiin-2-yl)butan-1-ol Traditional Name: 2-(10,10-diketophenoxathiin-2-yl)butan-1-ol Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)C1=CC2=C(C=C1)OC3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CCC(CO)C1=CC2=C(C=C1)OC3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C16H16O4S/c1-2-11(10-17)12-7-8-14-16(9-12)21(18,19)15-6-4-3-5-13(15)20-14/h3-9,11,17H,2,10H2,1H3