S-[(E,3R)-hept-4-en-3-yl] benzenecarbothioate

Systemtic Name: S-[(E,3R)-hept-4-en-3-yl] benzenecarbothioate Openeye Name: S-[(E,1R)-1-ethylpent-2-enyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[(E,3R)-hept-4-en-3-yl] ester IUPAC Name: S-[(E,3R)-hept-4-en-3-yl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[(E,1R)-1-ethylpent-2-enyl] ester Formula: C14H18OS MolecularWeight: 234.35712

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(CC)SC(=O)C1=CC=CC=C1

Isomeric SMILES

CC/C=C/[C@@H](CC)SC(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H18OS/c1-3-5-11-13(4-2)16-14(15)12-9-7-6-8-10-12/h5-11,13H,3-4H2,1-2H3/b11-5+/t13-/m1/s1