S-[(3R)-1-oxidanylhexan-3-yl] anthracene-2-carbothioate

Systemtic Name: S-[(3R)-1-oxidanylhexan-3-yl] anthracene-2-carbothioate Openeye Name: S-[(1R)-1-(2-hydroxyethyl)butyl] anthracene-2-carbothioate CAS Name: 2-anthracenecarbothioic acid S-[(3R)-1-hydroxyhexan-3-yl] ester IUPAC Name: S-[(3R)-1-hydroxyhexan-3-yl] anthracene-2-carbothioate Traditional Name: anthracene-2-carbothioic acid S-[(1R)-1-(2-hydroxyethyl)butyl] ester Formula: C21H22O2S MolecularWeight: 338.46318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCO)SC(=O)C1=CC2=CC3=CC=CC=C3C=C2C=C1

Isomeric SMILES

CCC[C@H](CCO)SC(=O)C1=CC2=CC3=CC=CC=C3C=C2C=C1

InChI

InChI=1S/C21H22O2S/c1-2-5-20(10-11-22)24-21(23)18-9-8-17-12-15-6-3-4-7-16(15)13-19(17)14-18/h3-4,6-9,12-14,20,22H,2,5,10-11H2,1H3/t20-/m1/s1