S-(2-methanoyl-3-phenyl-propyl) benzenecarbothioate

Systemtic Name: S-(2-methanoyl-3-phenyl-propyl) benzenecarbothioate Openeye Name: S-(2-benzyl-3-oxo-propyl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(2-formyl-3-phenylpropyl) ester IUPAC Name: S-(2-benzyl-3-oxopropyl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(2-benzyl-3-keto-propyl) ester Formula: C17H16O2S MolecularWeight: 284.37274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CSC(=O)C2=CC=CC=C2)C=O

Isomeric SMILES

C1=CC=C(C=C1)CC(CSC(=O)C2=CC=CC=C2)C=O

InChI

InChI=1S/C17H16O2S/c18-12-15(11-14-7-3-1-4-8-14)13-20-17(19)16-9-5-2-6-10-16/h1-10,12,15H,11,13H2