3-butyl-1-sulfanyl-xanthen-9-one

Systemtic Name: 3-butyl-1-sulfanyl-xanthen-9-one Openeye Name: 3-butyl-1-sulfanyl-xanthen-9-one CAS Name: 3-butyl-1-mercapto-9-xanthenone IUPAC Name: 3-butyl-1-sulfanylxanthen-9-one Traditional Name: 3-butyl-1-mercapto-xanthone Formula: C17H16O2S MolecularWeight: 284.37274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C(=C1)S)C(=O)C3=CC=CC=C3O2

Isomeric SMILES

CCCCC1=CC2=C(C(=C1)S)C(=O)C3=CC=CC=C3O2

InChI

InChI=1S/C17H16O2S/c1-2-3-6-11-9-14-16(15(20)10-11)17(18)12-7-4-5-8-13(12)19-14/h4-5,7-10,20H,2-3,6H2,1H3