(3R,4S)-3-ethyl-4-sulfanyl-3,4-dihydroisochromen-1-one

Systemtic Name: (3R,4S)-3-ethyl-4-sulfanyl-3,4-dihydroisochromen-1-one Openeye Name: (3R,4S)-3-ethyl-4-sulfanyl-isochroman-1-one CAS Name: (3R,4S)-3-ethyl-4-mercapto-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: (3R,4S)-3-ethyl-4-sulfanyl-3,4-dihydroisochromen-1-one Traditional Name: (3R,4S)-3-ethyl-4-mercapto-isochroman-1-one Formula: C11H12O2S MolecularWeight: 208.27678

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C2=CC=CC=C2C(=O)O1)S

Isomeric SMILES

CC[C@@H]1[C@H](C2=CC=CC=C2C(=O)O1)S

InChI

InChI=1S/C11H12O2S/c1-2-9-10(14)7-5-3-4-6-8(7)11(12)13-9/h3-6,9-10,14H,2H2,1H3/t9-,10+/m1/s1