7-butoxy-2,3-dihydrothiochromen-4-one

Systemtic Name: 7-butoxy-2,3-dihydrothiochromen-4-one Openeye Name: 7-butoxythiochroman-4-one CAS Name: 7-butoxy-2,3-dihydro-1-benzothiopyran-4-one IUPAC Name: 7-butoxy-2,3-dihydrothiochromen-4-one Traditional Name: 7-butoxythiochroman-4-one Formula: C13H16O2S MolecularWeight: 236.32994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=O)CCS2

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=O)CCS2

InChI

InChI=1S/C13H16O2S/c1-2-3-7-15-10-4-5-11-12(14)6-8-16-13(11)9-10/h4-5,9H,2-3,6-8H2,1H3